Carboxylic acids and derivatives















Filtered Search Results

Methyl 3-(2-morpholin-4-ylethoxy)benzoate, 97%, Thermo Scientific™
CAS: 249937-00-6 Molecular Formula: C14H19NO4 Molecular Weight (g/mol): 265.31 MDL Number: MFCD08060518 InChI Key: VOYSHDFODOJUMP-UHFFFAOYSA-N Synonym: methyl 3-2-morpholin-4-ylethoxy benzoate,methyl 3-2-morpholin-4-yl ethoxy benzoate,methyl 3-2-morpholinoethoxy benzoate,methyl 3-2-morpholin4-ylethoxy benzoate,3-2-morpholin-4-yl-ethoxy-benzoic acid methyl ester,benzoic acid,3-2-4-morpholinyl ethoxy-, methyl ester PubChem CID: 7164628 IUPAC Name: methyl 3-(2-morpholin-4-ylethoxy)benzoate SMILES: COC(=O)C1=CC(OCCN2CCOCC2)=CC=C1
PubChem CID | 7164628 |
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CAS | 249937-00-6 |
Molecular Weight (g/mol) | 265.31 |
MDL Number | MFCD08060518 |
SMILES | COC(=O)C1=CC(OCCN2CCOCC2)=CC=C1 |
Synonym | methyl 3-2-morpholin-4-ylethoxy benzoate,methyl 3-2-morpholin-4-yl ethoxy benzoate,methyl 3-2-morpholinoethoxy benzoate,methyl 3-2-morpholin4-ylethoxy benzoate,3-2-morpholin-4-yl-ethoxy-benzoic acid methyl ester,benzoic acid,3-2-4-morpholinyl ethoxy-, methyl ester |
IUPAC Name | methyl 3-(2-morpholin-4-ylethoxy)benzoate |
InChI Key | VOYSHDFODOJUMP-UHFFFAOYSA-N |
Molecular Formula | C14H19NO4 |
1-Methyl-1H-pyrazole-3-carboxylic acid, 95%, Thermo Scientific™
CAS: 25016-20-0 Molecular Formula: C5H6N2O2 Molecular Weight (g/mol): 126.12 MDL Number: MFCD00464254 InChI Key: YBFIKNNFQIBIQZ-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrazole-3-carboxylic acid,1h-pyrazole-3-carboxylic acid, 1-methyl,3-carboxy-1-methyl-1h-pyrazole,zlchem 1152,acmc-209ggi,1-methylpyrazolecarboxylic acid,1-methyl-pyrazole-3-carboxylic acid,pyrazole-3-carboxylic acid, 1-methyl,1h-pyrazole-3-carboxylicacid, 1-methyl,1-methyl-1h-4-pyrazole-3-carboxylic acid PubChem CID: 573176 ChEBI: CHEBI:74738 IUPAC Name: 1-methylpyrazole-3-carboxylic acid SMILES: CN1C=CC(=N1)C(O)=O
PubChem CID | 573176 |
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CAS | 25016-20-0 |
Molecular Weight (g/mol) | 126.12 |
ChEBI | CHEBI:74738 |
MDL Number | MFCD00464254 |
SMILES | CN1C=CC(=N1)C(O)=O |
Synonym | 1-methyl-1h-pyrazole-3-carboxylic acid,1h-pyrazole-3-carboxylic acid, 1-methyl,3-carboxy-1-methyl-1h-pyrazole,zlchem 1152,acmc-209ggi,1-methylpyrazolecarboxylic acid,1-methyl-pyrazole-3-carboxylic acid,pyrazole-3-carboxylic acid, 1-methyl,1h-pyrazole-3-carboxylicacid, 1-methyl,1-methyl-1h-4-pyrazole-3-carboxylic acid |
IUPAC Name | 1-methylpyrazole-3-carboxylic acid |
InChI Key | YBFIKNNFQIBIQZ-UHFFFAOYSA-N |
Molecular Formula | C5H6N2O2 |
Methyl 3-[3-(dimethylamino)propoxy]benzoate, 97%, Thermo Scientific™
CAS: 921938-75-2 Molecular Formula: C13H19NO3 Molecular Weight (g/mol): 237.299 MDL Number: MFCD09702393 InChI Key: WGAZXKVAWOAUOI-UHFFFAOYSA-N Synonym: methyl 3-3-dimethylamino propoxy benzoate PubChem CID: 24229605 IUPAC Name: methyl 3-[3-(dimethylamino)propoxy]benzoate SMILES: CN(C)CCCOC1=CC=CC(=C1)C(=O)OC
PubChem CID | 24229605 |
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CAS | 921938-75-2 |
Molecular Weight (g/mol) | 237.299 |
MDL Number | MFCD09702393 |
SMILES | CN(C)CCCOC1=CC=CC(=C1)C(=O)OC |
Synonym | methyl 3-3-dimethylamino propoxy benzoate |
IUPAC Name | methyl 3-[3-(dimethylamino)propoxy]benzoate |
InChI Key | WGAZXKVAWOAUOI-UHFFFAOYSA-N |
Molecular Formula | C13H19NO3 |
1H-Imidazole-2-carboxylic acid, 97%, Thermo Scientific™
CAS: 16042-25-4 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.088 InChI Key: KYWMCFOWDYFYLV-UHFFFAOYSA-N Synonym: 2-imidazolecarboxylic acid,imidazole-2-carboxylic acid,unii-o9g6515vc1,1h-imidazolecarboxylic acid,2-imidazolecarboxylicacid,2-imidazocarboxylic acid,1h-imidazole-2-carboxylicacid,imidazolecarboxylic,acmc-1avrt,2-carboxy-1h-imidazole PubChem CID: 574321 IUPAC Name: 1H-imidazole-2-carboxylic acid SMILES: C1=CN=C(N1)C(=O)O
PubChem CID | 574321 |
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CAS | 16042-25-4 |
Molecular Weight (g/mol) | 112.088 |
SMILES | C1=CN=C(N1)C(=O)O |
Synonym | 2-imidazolecarboxylic acid,imidazole-2-carboxylic acid,unii-o9g6515vc1,1h-imidazolecarboxylic acid,2-imidazolecarboxylicacid,2-imidazocarboxylic acid,1h-imidazole-2-carboxylicacid,imidazolecarboxylic,acmc-1avrt,2-carboxy-1h-imidazole |
IUPAC Name | 1H-imidazole-2-carboxylic acid |
InChI Key | KYWMCFOWDYFYLV-UHFFFAOYSA-N |
Molecular Formula | C4H4N2O2 |
Tris(2-Carboxyethyl)Phosphine Hydrochloride, 98%, Molecular Biology Grade, PROMO, Thermo Scientific Chemicals
CAS: 51805-45-9 Molecular Formula: C9H12O6P Molecular Weight (g/mol): 247.16 g/mol MDL Number: MFCD00145469 InChI Key: PZBFGYYEXUXCOF-UHFFFAOYSA-K Synonym: tris 2-carboxyethyl phosphine hydrochloride,tcep hcl,tcep hydrochloride,3,3',3-phosphinetriyltripropanoic acid hydrochloride,tcep,unii-h49aam893k,tris carboxyethyl phosphine hydrochloride,tris-2-carboxyethyl phosphine hydrochloride,tris 2-carboxyethyl phosphine hcl,3,3',3-phosphinetriyltripropanoicacidhydrochloride PubChem CID: 2734570 IUPAC Name: 3-[bis(2-carboxyethyl)phosphanyl]propanoic acid;hydrochloride SMILES: [O-]C(=O)CCP(CCC([O-])=O)CCC([O-])=O
PubChem CID | 2734570 |
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CAS | 51805-45-9 |
Molecular Weight (g/mol) | 247.16 g/mol |
MDL Number | MFCD00145469 |
SMILES | [O-]C(=O)CCP(CCC([O-])=O)CCC([O-])=O |
Synonym | tris 2-carboxyethyl phosphine hydrochloride,tcep hcl,tcep hydrochloride,3,3',3-phosphinetriyltripropanoic acid hydrochloride,tcep,unii-h49aam893k,tris carboxyethyl phosphine hydrochloride,tris-2-carboxyethyl phosphine hydrochloride,tris 2-carboxyethyl phosphine hcl,3,3',3-phosphinetriyltripropanoicacidhydrochloride |
IUPAC Name | 3-[bis(2-carboxyethyl)phosphanyl]propanoic acid;hydrochloride |
InChI Key | PZBFGYYEXUXCOF-UHFFFAOYSA-K |
Molecular Formula | C9H12O6P |
Thapsigargin, 95%, PROMO, Thermo Scientific Chemicals
CAS: 67526-95-8 Molecular Formula: C34H50O12 Molecular Weight (g/mol): 650.76 g/mol MDL Number: MFCD00083511 InChI Key: IXFPJGBNCFXKPI-FSIHEZPISA-N Synonym: thapsigargin,unii-z96bq26rzd,z96bq26rzd,chembl96926,octanoic acid 3s-3alpha, 3abeta, 4alpha, 6beta, 6abeta, 7beta, 8alpha z , 9balpha-6-acetyloxy-2,3,-3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy-azuleno 4,5-b furan-7-yl ester,octanoic acid, 6-acetyloxy-2,3,3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy azuleno 4,5-b furan-7-yl ester, 3s-3alpha,3abeta,4alpha,6beta,6abeta,7beta,8alpha z ,9balpha,tg1,--thapsigargin,octanoic acid 3s-3alpha, 3abeta, 4alpha, 6beta,6abeta, 7beta, 8alpha z , 9balpha-6-acetyloxy-2,3,-3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy-azuleno 4,5-b furan-7-yl ester,octanoic acid 3s-3alpha, 3abeta, 4alpha,6beta, 6abeta, 7beta, 8alpha z , 9balpha-6-acetyloxy-2,3,-3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy-azuleno 4,5-b furan-7-yl ester PubChem CID: 126969181 IUPAC Name: [(3S,3aR,4S,6S,6aS,7S,8S,9bR)-6-acetyloxy-4-butanoyloxy-3,3a-dihydroxy-3,6,9-trimethyl-8-(2-methylbut-2-enoyloxy)-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-7-yl] octanoate SMILES: CCCCCCCC(=O)O[C@@H]1[C@@H](OC(=O)C(\C)=C/C)C(C)=C2[C@@H]3OC(=O)[C@@](C)(O)[C@@]3(O)[C@H](C[C@](C)(OC(C)=O)[C@@H]12)OC(=O)CCC
PubChem CID | 126969181 |
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CAS | 67526-95-8 |
Molecular Weight (g/mol) | 650.76 g/mol |
MDL Number | MFCD00083511 |
SMILES | CCCCCCCC(=O)O[C@@H]1[C@@H](OC(=O)C(\C)=C/C)C(C)=C2[C@@H]3OC(=O)[C@@](C)(O)[C@@]3(O)[C@H](C[C@](C)(OC(C)=O)[C@@H]12)OC(=O)CCC |
Synonym | thapsigargin,unii-z96bq26rzd,z96bq26rzd,chembl96926,octanoic acid 3s-3alpha, 3abeta, 4alpha, 6beta, 6abeta, 7beta, 8alpha z , 9balpha-6-acetyloxy-2,3,-3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy-azuleno 4,5-b furan-7-yl ester,octanoic acid, 6-acetyloxy-2,3,3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy azuleno 4,5-b furan-7-yl ester, 3s-3alpha,3abeta,4alpha,6beta,6abeta,7beta,8alpha z ,9balpha,tg1,--thapsigargin,octanoic acid 3s-3alpha, 3abeta, 4alpha, 6beta,6abeta, 7beta, 8alpha z , 9balpha-6-acetyloxy-2,3,-3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy-azuleno 4,5-b furan-7-yl ester,octanoic acid 3s-3alpha, 3abeta, 4alpha,6beta, 6abeta, 7beta, 8alpha z , 9balpha-6-acetyloxy-2,3,-3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy-azuleno 4,5-b furan-7-yl ester |
IUPAC Name | [(3S,3aR,4S,6S,6aS,7S,8S,9bR)-6-acetyloxy-4-butanoyloxy-3,3a-dihydroxy-3,6,9-trimethyl-8-(2-methylbut-2-enoyloxy)-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-7-yl] octanoate |
InChI Key | IXFPJGBNCFXKPI-FSIHEZPISA-N |
Molecular Formula | C34H50O12 |
5-Amino-1-methyl-1H-pyrazole-4-carboxamide, Thermo Scientific™
CAS: 18213-75-7 Molecular Formula: C5H8N4O Molecular Weight (g/mol): 140.146 MDL Number: MFCD00111808 InChI Key: JGSQVTVXGXOSCH-UHFFFAOYSA-N PubChem CID: 265696 IUPAC Name: 5-amino-1-methylpyrazole-4-carboxamide SMILES: CN1C(=C(C=N1)C(=O)N)N
PubChem CID | 265696 |
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CAS | 18213-75-7 |
Molecular Weight (g/mol) | 140.146 |
MDL Number | MFCD00111808 |
SMILES | CN1C(=C(C=N1)C(=O)N)N |
IUPAC Name | 5-amino-1-methylpyrazole-4-carboxamide |
InChI Key | JGSQVTVXGXOSCH-UHFFFAOYSA-N |
Molecular Formula | C5H8N4O |
2,3,5-Tri-O-Benzoyl-1-O-Acetyl-β-D-Ribofuranose, MP Biomedicals
CAS: 6974-32-9 Molecular Formula: C28H24O9 Molecular Weight (g/mol): 504.491 InChI Key: GCZABPLTDYVJMP-CBUXHAPBSA-N Synonym: 1-o-acetyl-2,3,5-tri-o-benzoyl-beta-d-ribofuranose,beta-d-ribofuranose 1-acetate 2,3,5-tribenzoate,2r,3r,4r,5s-5-acetyloxy-3,4-bis benzoyloxy oxolan-2-yl methyl benzoate,1-acetyl-2,3,5-tribenzoyl-beta-d-ribofuranose,1-acetyl-2,3,5-tribenzoy-b-d-ribofuranose,1-o-acetyl-2,3,5,tri-o-benzyl-beta-d-ribofuranose,2r,3r,4r,5s-5-acetyloxy-3,4-dibenzoyloxyoxolan-2-yl methyl benzoate,2s,3r,4r,5r-2-acetoxy-5-benzoyloxymethyl tetrahydrofuran-3,4-diyl dibenzoate,.beta.-d-ribofuranose, 1-acetate 2,3,5-tribenzoate,2s,3r,4r,5r-2-acetoxy-5-benzoyloxy methyl tetrahydrofuran-3,4-diyl dibenzoate PubChem CID: 81455 IUPAC Name: [(2R,3R,4R,5S)-5-acetyloxy-3,4-dibenzoyloxyoxolan-2-yl]methyl benzoate SMILES: CC(=O)OC1C(C(C(O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4
PubChem CID | 81455 |
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CAS | 6974-32-9 |
Molecular Weight (g/mol) | 504.491 |
SMILES | CC(=O)OC1C(C(C(O1)COC(=O)C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4 |
Synonym | 1-o-acetyl-2,3,5-tri-o-benzoyl-beta-d-ribofuranose,beta-d-ribofuranose 1-acetate 2,3,5-tribenzoate,2r,3r,4r,5s-5-acetyloxy-3,4-bis benzoyloxy oxolan-2-yl methyl benzoate,1-acetyl-2,3,5-tribenzoyl-beta-d-ribofuranose,1-acetyl-2,3,5-tribenzoy-b-d-ribofuranose,1-o-acetyl-2,3,5,tri-o-benzyl-beta-d-ribofuranose,2r,3r,4r,5s-5-acetyloxy-3,4-dibenzoyloxyoxolan-2-yl methyl benzoate,2s,3r,4r,5r-2-acetoxy-5-benzoyloxymethyl tetrahydrofuran-3,4-diyl dibenzoate,.beta.-d-ribofuranose, 1-acetate 2,3,5-tribenzoate,2s,3r,4r,5r-2-acetoxy-5-benzoyloxy methyl tetrahydrofuran-3,4-diyl dibenzoate |
IUPAC Name | [(2R,3R,4R,5S)-5-acetyloxy-3,4-dibenzoyloxyoxolan-2-yl]methyl benzoate |
InChI Key | GCZABPLTDYVJMP-CBUXHAPBSA-N |
Molecular Formula | C28H24O9 |
Diazolidinyl urea, MP Biomedicals™
CAS: 78491028 Molecular Formula: C8H14N4O7 Molecular Weight (g/mol): 278.221 InChI Key: SOROIESOUPGGFO-UHFFFAOYSA-N Synonym: diazolidinylurea,diazolidinyl urea,1-1,3-bis hydroxymethyl-2,5-dioxoimidazolidin-4-yl-1,3-bis hydroxymethyl urea,germall ii,germall 11,imidazolidinyl urea 11,n,n'-bis hydroxymethyl urea,dsstox_cid_9559,dsstox_rid_78776 PubChem CID: 62277 IUPAC Name: 1-[1,3-bis(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]-1,3-bis(hydroxymethyl)urea SMILES: C(NC(=O)N(CO)C1C(=O)N(C(=O)N1CO)CO)O
PubChem CID | 62277 |
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CAS | 78491028 |
Molecular Weight (g/mol) | 278.221 |
SMILES | C(NC(=O)N(CO)C1C(=O)N(C(=O)N1CO)CO)O |
Synonym | diazolidinylurea,diazolidinyl urea,1-1,3-bis hydroxymethyl-2,5-dioxoimidazolidin-4-yl-1,3-bis hydroxymethyl urea,germall ii,germall 11,imidazolidinyl urea 11,n,n'-bis hydroxymethyl urea,dsstox_cid_9559,dsstox_rid_78776 |
IUPAC Name | 1-[1,3-bis(hydroxymethyl)-2,5-dioxoimidazolidin-4-yl]-1,3-bis(hydroxymethyl)urea |
InChI Key | SOROIESOUPGGFO-UHFFFAOYSA-N |
Molecular Formula | C8H14N4O7 |
Clomiphene citrate salt, MP Biomedicals™
CAS: 50-41-9 Molecular Formula: C32H36ClNO8 Molecular Weight (g/mol): 598.089 InChI Key: PYTMYKVIJXPNBD-BTKVJIOYSA-N Synonym: clomifene citrate,clomiphene citrate,clomid,cis-clomiphene citrate,clomiphene a citrate,zuclomid,chloramiphene,milophene,serophene,z-clomiphene citrate PubChem CID: 6420009 IUPAC Name: 2-[4-[(E)-2-chloro-1,2-diphenylethenyl]phenoxy]-N,N-diethylethanamine;2-hydroxypropane-1,2,3-tricarboxylic acid SMILES: CCN(CC)CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
PubChem CID | 6420009 |
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CAS | 50-41-9 |
Molecular Weight (g/mol) | 598.089 |
SMILES | CCN(CC)CCOC1=CC=C(C=C1)C(=C(C2=CC=CC=C2)Cl)C3=CC=CC=C3.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
Synonym | clomifene citrate,clomiphene citrate,clomid,cis-clomiphene citrate,clomiphene a citrate,zuclomid,chloramiphene,milophene,serophene,z-clomiphene citrate |
IUPAC Name | 2-[4-[(E)-2-chloro-1,2-diphenylethenyl]phenoxy]-N,N-diethylethanamine;2-hydroxypropane-1,2,3-tricarboxylic acid |
InChI Key | PYTMYKVIJXPNBD-BTKVJIOYSA-N |
Molecular Formula | C32H36ClNO8 |
Sodium oxalate, For ACS analysis, 99.96%, MP Biomedicals™
CAS: 62-76-0 Molecular Formula: C2Na2O4 Molecular Weight (g/mol): 134 MDL Number: MFCD00012465 InChI Key: ZNCPFRVNHGOPAG-UHFFFAOYSA-L Synonym: sodium oxalate,disodium oxalate,natriumoxalat,ethanedioic acid, disodium salt,oxalic acid, disodium salt,natriumoxalat german,stavelan sodny czech,oxalic acid disodium salt,unii-7u0v68lt9x,ethanedioic acid disodium salt PubChem CID: 6125 IUPAC Name: disodium oxalate SMILES: [Na+].[Na+].[O-]C(=O)C([O-])=O
PubChem CID | 6125 |
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CAS | 62-76-0 |
Molecular Weight (g/mol) | 134 |
MDL Number | MFCD00012465 |
SMILES | [Na+].[Na+].[O-]C(=O)C([O-])=O |
Synonym | sodium oxalate,disodium oxalate,natriumoxalat,ethanedioic acid, disodium salt,oxalic acid, disodium salt,natriumoxalat german,stavelan sodny czech,oxalic acid disodium salt,unii-7u0v68lt9x,ethanedioic acid disodium salt |
IUPAC Name | disodium oxalate |
InChI Key | ZNCPFRVNHGOPAG-UHFFFAOYSA-L |
Molecular Formula | C2Na2O4 |
Sodium citrate, 99.8%, For ACS analysis, MP Biomedicals™
CAS: 6132-04-3 Molecular Formula: C6H9Na3O9 Molecular Weight (g/mol): 294.1 InChI Key: NLJMYIDDQXHKNR-UHFFFAOYSA-K Synonym: trisodium citrate dihydrate,sodium citrate dihydrate,sodium citrate tribasic dihydrate,natriumcitrat-dihydrat,sodium citrate hydrate,1,2,3-propanetricarboxylic acid, 2-hydroxy-, trisodium salt, dihydrate,citronensaeure-tri-na-salz-dihydrat,citric acid trisodium salt dihydrate,citric acid, trisodium salt dihydrate,trisodium 2-hydroxypropane-1,2,3-tricarboxylate dihydrate PubChem CID: 71474 ChEBI: CHEBI:32142 IUPAC Name: trisodium;2-hydroxypropane-1,2,3-tricarboxylate;dihydrate SMILES: C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.[Na+].[Na+].[Na+]
PubChem CID | 71474 |
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CAS | 6132-04-3 |
Molecular Weight (g/mol) | 294.1 |
ChEBI | CHEBI:32142 |
SMILES | C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.O.O.[Na+].[Na+].[Na+] |
Synonym | trisodium citrate dihydrate,sodium citrate dihydrate,sodium citrate tribasic dihydrate,natriumcitrat-dihydrat,sodium citrate hydrate,1,2,3-propanetricarboxylic acid, 2-hydroxy-, trisodium salt, dihydrate,citronensaeure-tri-na-salz-dihydrat,citric acid trisodium salt dihydrate,citric acid, trisodium salt dihydrate,trisodium 2-hydroxypropane-1,2,3-tricarboxylate dihydrate |
IUPAC Name | trisodium;2-hydroxypropane-1,2,3-tricarboxylate;dihydrate |
InChI Key | NLJMYIDDQXHKNR-UHFFFAOYSA-K |
Molecular Formula | C6H9Na3O9 |
2-Keto-D-gluconic acid, hemicalcium salt monohydrate, >98%, MP Biomedicals™
CAS: 3470-37-9 Molecular Formula: C12H20CaO14 Molecular Weight (g/mol): 428.356 MDL Number: MFCD00149104 InChI Key: QACANIDDQFGAJU-JQTJLMCZSA-N Synonym: calcium 2-keto-d-gluconate PubChem CID: 131852723 IUPAC Name: calcium;(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexanoic acid SMILES: C(C(C(C(C(=O)C(=O)O)O)O)O)O.C(C(C(C(C(=O)C(=O)O)O)O)O)O.[Ca]
PubChem CID | 131852723 |
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CAS | 3470-37-9 |
Molecular Weight (g/mol) | 428.356 |
MDL Number | MFCD00149104 |
SMILES | C(C(C(C(C(=O)C(=O)O)O)O)O)O.C(C(C(C(C(=O)C(=O)O)O)O)O)O.[Ca] |
Synonym | calcium 2-keto-d-gluconate |
IUPAC Name | calcium;(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexanoic acid |
InChI Key | QACANIDDQFGAJU-JQTJLMCZSA-N |
Molecular Formula | C12H20CaO14 |
Thapsigargin, 99% (TLC), 97.6% (HPLC), MP Biomedicals™
CAS: 67526958 Molecular Formula: C34H50O12 Molecular Weight (g/mol): 650.76 MDL Number: MFCD00083511 InChI Key: IXFPJGBNCFXKPI-FSIHEZPISA-N Synonym: thapsigargin,unii-z96bq26rzd,z96bq26rzd,chembl96926,octanoic acid 3s-3alpha, 3abeta, 4alpha, 6beta, 6abeta, 7beta, 8alpha z , 9balpha-6-acetyloxy-2,3,-3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy-azuleno 4,5-b furan-7-yl ester,octanoic acid, 6-acetyloxy-2,3,3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy azuleno 4,5-b furan-7-yl ester, 3s-3alpha,3abeta,4alpha,6beta,6abeta,7beta,8alpha z ,9balpha,tg1,--thapsigargin,octanoic acid 3s-3alpha, 3abeta, 4alpha, 6beta,6abeta, 7beta, 8alpha z , 9balpha-6-acetyloxy-2,3,-3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy-azuleno 4,5-b furan-7-yl ester,octanoic acid 3s-3alpha, 3abeta, 4alpha,6beta, 6abeta, 7beta, 8alpha z , 9balpha-6-acetyloxy-2,3,-3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy-azuleno 4,5-b furan-7-yl ester PubChem CID: 126969181 IUPAC Name: (3S,3aR,4S,6S,6aR,7S,8S,9bS)-6-(acetyloxy)-4-(butanoyloxy)-3,3a-dihydroxy-3,6,9-trimethyl-8-{[(2Z)-2-methylbut-2-enoyl]oxy}-2-oxo-2H,3H,3aH,4H,5H,6H,6aH,7H,8H,9bH-azuleno[4,5-b]furan-7-yl octanoate SMILES: CCCCCCCC(=O)O[C@@H]1[C@@H](OC(=O)C(\C)=C/C)C(C)=C2[C@@H]3OC(=O)[C@@](C)(O)[C@@]3(O)[C@H](C[C@](C)(OC(C)=O)[C@@H]12)OC(=O)CCC
PubChem CID | 126969181 |
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CAS | 67526958 |
Molecular Weight (g/mol) | 650.76 |
MDL Number | MFCD00083511 |
SMILES | CCCCCCCC(=O)O[C@@H]1[C@@H](OC(=O)C(\C)=C/C)C(C)=C2[C@@H]3OC(=O)[C@@](C)(O)[C@@]3(O)[C@H](C[C@](C)(OC(C)=O)[C@@H]12)OC(=O)CCC |
Synonym | thapsigargin,unii-z96bq26rzd,z96bq26rzd,chembl96926,octanoic acid 3s-3alpha, 3abeta, 4alpha, 6beta, 6abeta, 7beta, 8alpha z , 9balpha-6-acetyloxy-2,3,-3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy-azuleno 4,5-b furan-7-yl ester,octanoic acid, 6-acetyloxy-2,3,3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy azuleno 4,5-b furan-7-yl ester, 3s-3alpha,3abeta,4alpha,6beta,6abeta,7beta,8alpha z ,9balpha,tg1,--thapsigargin,octanoic acid 3s-3alpha, 3abeta, 4alpha, 6beta,6abeta, 7beta, 8alpha z , 9balpha-6-acetyloxy-2,3,-3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy-azuleno 4,5-b furan-7-yl ester,octanoic acid 3s-3alpha, 3abeta, 4alpha,6beta, 6abeta, 7beta, 8alpha z , 9balpha-6-acetyloxy-2,3,-3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-8-2-methyl-1-oxo-2-butenyl oxy-2-oxo-4-1-oxobutoxy-azuleno 4,5-b furan-7-yl ester |
IUPAC Name | (3S,3aR,4S,6S,6aR,7S,8S,9bS)-6-(acetyloxy)-4-(butanoyloxy)-3,3a-dihydroxy-3,6,9-trimethyl-8-{[(2Z)-2-methylbut-2-enoyl]oxy}-2-oxo-2H,3H,3aH,4H,5H,6H,6aH,7H,8H,9bH-azuleno[4,5-b]furan-7-yl octanoate |
InChI Key | IXFPJGBNCFXKPI-FSIHEZPISA-N |
Molecular Formula | C34H50O12 |
Methyle3,4-diaminobenzoate, 97%, Thermo Scientific™
CAS: 36692-49-6 Molecular Formula: C8H10N2O2 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00017098 InChI Key: IOPLHGOSNCJOOO-UHFFFAOYSA-N Synonym: 3,4-diaminobenzoic acid methyl ester,methyl3,4-diaminobenzoate,methyl-3,4-diaminobenzoate,benzoic acid, 3,4-diamino-, methyl ester,3,4-diamino-benzoic acid methyl ester,methyl 3,4-diaminobenzenecarboxylate,pubchem4610,acmc-1bn7s,methyl 3,4-diamino-benzoate,methyl-3,4-diamino-benzoate PubChem CID: 135524 IUPAC Name: methyl 3,4-diaminobenzoate SMILES: COC(=O)C1=CC=C(N)C(N)=C1
PubChem CID | 135524 |
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CAS | 36692-49-6 |
Molecular Weight (g/mol) | 166.18 |
MDL Number | MFCD00017098 |
SMILES | COC(=O)C1=CC=C(N)C(N)=C1 |
Synonym | 3,4-diaminobenzoic acid methyl ester,methyl3,4-diaminobenzoate,methyl-3,4-diaminobenzoate,benzoic acid, 3,4-diamino-, methyl ester,3,4-diamino-benzoic acid methyl ester,methyl 3,4-diaminobenzenecarboxylate,pubchem4610,acmc-1bn7s,methyl 3,4-diamino-benzoate,methyl-3,4-diamino-benzoate |
IUPAC Name | methyl 3,4-diaminobenzoate |
InChI Key | IOPLHGOSNCJOOO-UHFFFAOYSA-N |
Molecular Formula | C8H10N2O2 |