Unclassified Organic Compounds

Organic compounds that do not fit into any other organic chemical classification.

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2,311 – 2,325 of 207,757 results

2,311

Dantrolene sodium salt

CAS: 14663-23-1 Molecular Formula: C14H12N4NaO5 Molecular Weight (g/mol): 339.263 MDL Number: MFCD00079130 InChI Key: XHONPQLVCHTEDY-YVCISUPJSA-N PubChem CID: 131674048 IUPAC Name: molecular hydrogen;1-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]imidazolidine-2,4-dione;sodium SMILES: [HH].C1C(=O)NC(=O)N1N=CC2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-].[Na]

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Specifications

PubChem CID	131674048
CAS	14663-23-1
Molecular Weight (g/mol)	339.263
MDL Number	MFCD00079130
SMILES	[HH].C1C(=O)NC(=O)N1N=CC2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-].[Na]
IUPAC Name	molecular hydrogen;1-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylideneamino]imidazolidine-2,4-dione;sodium
InChI Key	XHONPQLVCHTEDY-YVCISUPJSA-N
Molecular Formula	C14H12N4NaO5

2,312

beta-Nicotinamide adenine dinucleotide phosphate reduced tetrasodium salt, 95%

CAS: 2646-71-1 Molecular Formula: C21H26N7Na4O17P3 Molecular Weight (g/mol): 833.35 MDL Number: MFCD10567216 InChI Key: WYWWVJHQDVCHKF-NRTBITFTNA-J Synonym: nadph tetrasodium salt,nadph, tetrasodium salt,coenzyme ii tetrasodium salt reduced form PubChem CID: 131673986 IUPAC Name: [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate;molecular hydrogen;sodium SMILES: [Na+].[Na+].[Na+].[Na+].NC(=O)C1=CN(C=CC1)[C@@H]1O[C@H](COP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](OP([O-])([O-])=O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O

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Specifications

PubChem CID	131673986
CAS	2646-71-1
Molecular Weight (g/mol)	833.35
MDL Number	MFCD10567216
SMILES	[Na+].[Na+].[Na+].[Na+].NC(=O)C1=CN(C=CC1)[C@@H]1O[C@H](COP([O-])(=O)OP([O-])(=O)OC[C@H]2O[C@H]([C@H](OP([O-])([O-])=O)[C@@H]2O)N2C=NC3=C(N)N=CN=C23)[C@@H](O)[C@H]1O
Synonym	nadph tetrasodium salt,nadph, tetrasodium salt,coenzyme ii tetrasodium salt reduced form
IUPAC Name	[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate;molecular hydrogen;sodium
InChI Key	WYWWVJHQDVCHKF-NRTBITFTNA-J
Molecular Formula	C21H26N7Na4O17P3

2,313

3,3',5-Triiodo-L-thyronine sodium salt

CAS: 55-06-1 Molecular Formula: C15H11I3NNaO4 Molecular Weight (g/mol): 672.959 MDL Number: MFCD00002594 InChI Key: SBXXSUDPJJJJLC-YDALLXLXSA-M Synonym: liothyronine sodium,cytomel,triostat,tertroxin,3,3',5-triiodo-l-thyronine sodium salt,basoprocin,ibiothyron,cynomel,cytomel sodium,triiodothyronine sodium PubChem CID: 23666110 ChEBI: CHEBI:6484 IUPAC Name: sodium;(2S)-2-amino-3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]propanoate SMILES: C1=CC(=C(C=C1OC2=C(C=C(C=C2I)CC(C(=O)[O-])N)I)I)O.[Na+]

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Specifications

PubChem CID	23666110
CAS	55-06-1
Molecular Weight (g/mol)	672.959
ChEBI	CHEBI:6484
MDL Number	MFCD00002594
SMILES	C1=CC(=C(C=C1OC2=C(C=C(C=C2I)CC(C(=O)[O-])N)I)I)O.[Na+]
Synonym	liothyronine sodium,cytomel,triostat,tertroxin,3,3',5-triiodo-l-thyronine sodium salt,basoprocin,ibiothyron,cynomel,cytomel sodium,triiodothyronine sodium
IUPAC Name	sodium;(2S)-2-amino-3-[4-(4-hydroxy-3-iodophenoxy)-3,5-diiodophenyl]propanoate
InChI Key	SBXXSUDPJJJJLC-YDALLXLXSA-M
Molecular Formula	C15H11I3NNaO4

2,314

Tetrasodium meso-tetra(sulfonatophenyl)porphine dodecahydrate, 95%

CAS: 122451-08-5 Molecular Formula: C44H54N4Na4O24S4 Molecular Weight (g/mol): 1243.119 MDL Number: MFCD00151011 InChI Key: CDOFYZDFUGMKDJ-UHFFFAOYSA-N Synonym: 4,4',4,4'-porphine-5,10,15,20-tetrayl tetrakis benzenesulfonic acid tetrasodium salt hydrate PubChem CID: 131869494 IUPAC Name: sodium;4-[10,15,20-tris(4-sulfophenyl)-21,24-dihydroporphyrin-5-yl]benzenesulfonic acid;dodecahydrate SMILES: C1=CC(=CC=C1C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)S(=O)(=O)O)C8=CC=C(C=C8)S(=O)(=O)O)C9=CC=C(C=C9)S(=O)(=O)O)N3)S(=O)(=O)O.O.O.O.O.O.O.O.O.O.O.O.O.[Na].[Na].[Na].[Na]

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Specifications

PubChem CID	131869494
CAS	122451-08-5
Molecular Weight (g/mol)	1243.119
MDL Number	MFCD00151011
SMILES	C1=CC(=CC=C1C2=C3C=CC(=C(C4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)S(=O)(=O)O)C8=CC=C(C=C8)S(=O)(=O)O)C9=CC=C(C=C9)S(=O)(=O)O)N3)S(=O)(=O)O.O.O.O.O.O.O.O.O.O.O.O.O.[Na].[Na].[Na].[Na]
Synonym	4,4',4,4'-porphine-5,10,15,20-tetrayl tetrakis benzenesulfonic acid tetrasodium salt hydrate
IUPAC Name	sodium;4-[10,15,20-tris(4-sulfophenyl)-21,24-dihydroporphyrin-5-yl]benzenesulfonic acid;dodecahydrate
InChI Key	CDOFYZDFUGMKDJ-UHFFFAOYSA-N
Molecular Formula	C44H54N4Na4O24S4

2,315

Azido-PEG3-biotin conjugate

CAS: 875770-34-6 Molecular Formula: C18H32N6O5S Molecular Weight (g/mol): 444.551 MDL Number: MFCD20134145 InChI Key: ZWFOOMQCYIGZBE-ZOBUZTSGSA-N Synonym: biotin-peg3-azide,n-2-2-2-2-azidoethoxy ethoxy ethoxy ethyl biotinamide,n-2-2-2-2-azidoethoxy ethoxy ethoxy ethyl-5-3as,4s,6ar-2-oxohexahydro-1h-thieno 3,4-d imidazol-4-yl pentanamide,biotin-peg4-n3,azide-peg3-biotin conjugate,azido-peg3-biotin conjugate,11-r-+-biotinylamino-1-azido-3,6,9-trioxaundecane,3abeta,6abeta-n-2-2-2-2-azidoethoxy ethoxy ethoxy ethyl-2-oxohexahydro-1h-thieno 3,4-d imidazole-4alpha-pentanamide PubChem CID: 60146223 IUPAC Name: 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]pentanamide SMILES: C1C2C(C(S1)CCCCC(=O)NCCOCCOCCOCCN=[N+]=[N-])NC(=O)N2

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Specifications

PubChem CID	60146223
CAS	875770-34-6
Molecular Weight (g/mol)	444.551
MDL Number	MFCD20134145
SMILES	C1C2C(C(S1)CCCCC(=O)NCCOCCOCCOCCN=[N+]=[N-])NC(=O)N2
Synonym	biotin-peg3-azide,n-2-2-2-2-azidoethoxy ethoxy ethoxy ethyl biotinamide,n-2-2-2-2-azidoethoxy ethoxy ethoxy ethyl-5-3as,4s,6ar-2-oxohexahydro-1h-thieno 3,4-d imidazol-4-yl pentanamide,biotin-peg4-n3,azide-peg3-biotin conjugate,azido-peg3-biotin conjugate,11-r-+-biotinylamino-1-azido-3,6,9-trioxaundecane,3abeta,6abeta-n-2-2-2-2-azidoethoxy ethoxy ethoxy ethyl-2-oxohexahydro-1h-thieno 3,4-d imidazole-4alpha-pentanamide
IUPAC Name	5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]pentanamide
InChI Key	ZWFOOMQCYIGZBE-ZOBUZTSGSA-N
Molecular Formula	C18H32N6O5S

2,316

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Azadibenzocyclooctyne-PEG, MW 5,000

Synonym: ADIBO-PEG, MW 5,000

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Specifications

Synonym	ADIBO-PEG, MW 5,000

2,317

N-Succinimidyl 4,7,10,13,16-pentaoxanonadec-18-ynoate

Molecular Formula: C₁₈H₂₇NO₉ MDL Number: MFCD22380743 Synonym: Acetylene-PEG5-NHS ester

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Specifications

MDL Number	MFCD22380743
Synonym	Acetylene-PEG5-NHS ester
Molecular Formula	C₁₈H₂₇NO₉

2,318

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Azadibenzocyclooctyne-PEG4-maleimide

Molecular Formula: C₃₆H₄₂N₄O₉ MDL Number: MFCD22380760 Synonym: ADIBO-PEG4-maleimide

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Specifications

MDL Number	MFCD22380760
Synonym	ADIBO-PEG4-maleimide
Molecular Formula	C₃₆H₄₂N₄O₉

2,319

Benzopurpurin 4B

CAS: 992-59-6 Molecular Formula: C34H26N6Na2O6S2 Molecular Weight (g/mol): 724.718 MDL Number: MFCD00012410 InChI Key: SUXCALIDMIIJCK-UHFFFAOYSA-L Synonym: benzopurpurine 4b,benzopurpurin 4b,direct red 2,c.i. direct red 2,amanil purpurine,diphenyl red 4b,hispamin red 4b,direct red dcb,azocard red 4b,diazine red 4b PubChem CID: 13816 IUPAC Name: disodium;4-amino-3-[[4-[4-[(1-amino-4-sulfonatonaphthalen-2-yl)diazenyl]-3-methylphenyl]-2-methylphenyl]diazenyl]naphthalene-1-sulfonate SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C4=CC=CC=C4C(=C3)S(=O)(=O)[O-])N)C)N=NC5=C(C6=CC=CC=C6C(=C5)S(=O)(=O)[O-])N.[Na+].[Na+]

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Specifications

PubChem CID	13816
CAS	992-59-6
Molecular Weight (g/mol)	724.718
MDL Number	MFCD00012410
SMILES	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=C(C4=CC=CC=C4C(=C3)S(=O)(=O)[O-])N)C)N=NC5=C(C6=CC=CC=C6C(=C5)S(=O)(=O)[O-])N.[Na+].[Na+]
Synonym	benzopurpurine 4b,benzopurpurin 4b,direct red 2,c.i. direct red 2,amanil purpurine,diphenyl red 4b,hispamin red 4b,direct red dcb,azocard red 4b,diazine red 4b
IUPAC Name	disodium;4-amino-3-[[4-[4-[(1-amino-4-sulfonatonaphthalen-2-yl)diazenyl]-3-methylphenyl]-2-methylphenyl]diazenyl]naphthalene-1-sulfonate
InChI Key	SUXCALIDMIIJCK-UHFFFAOYSA-L
Molecular Formula	C34H26N6Na2O6S2

2,320

D-myo-Inositol-1,2,3,6-tetrakis(phosphate) sodium salt, Thermo Scientific Chemicals

MDL Number: MFCD12912298 Synonym: 1,2,3,6-IP4 sodium salt; Ins(1,2,3,6)-P4 sodium salt

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Specifications

MDL Number	MFCD12912298
Synonym	1,2,3,6-IP4 sodium salt; Ins(1,2,3,6)-P4 sodium salt

2,321

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Azadibenzocyclooctyne-NHS ester, with 4 carbon linker

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2,322

Azido-PEG3-sulforhodamine 101 conjugate, Thermo Scientific Chemicals

CAS: 1353153-76-0 Molecular Formula: C₃₉H₄₆N₆O₉S₂ MDL Number: MFCD22380752 Synonym: Azide-Fluor 585

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Specifications

CAS	1353153-76-0
MDL Number	MFCD22380752
Synonym	Azide-Fluor 585
Molecular Formula	C₃₉H₄₆N₆O₉S₂

2,323

Thermo Scientific Chemicals Sisomicin sulfate, 90%

CAS: 53179-09-2 Molecular Formula: C19H39N5O11S Molecular Weight (g/mol): 545.605 MDL Number: MFCD00058308 InChI Key: JVTNJDPXUPRGIE-DAVQCCERSA-N Synonym: sisomicin sulfate PubChem CID: 123134107 IUPAC Name: (2S,3R,4S,5S)-2-[(2S,3S,4R,6S)-4,6-diamino-3-[[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol;sulfuric acid SMILES: CC1(COC(C(C1NC)O)OC2C(CC(C(C2O)OC3C(CC=C(O3)CN)N)N)N)O.OS(=O)(=O)O

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Specifications

PubChem CID	123134107
CAS	53179-09-2
Molecular Weight (g/mol)	545.605
MDL Number	MFCD00058308
SMILES	CC1(COC(C(C1NC)O)OC2C(CC(C(C2O)OC3C(CC=C(O3)CN)N)N)N)O.OS(=O)(=O)O
Synonym	sisomicin sulfate
IUPAC Name	(2S,3R,4S,5S)-2-[(2S,3S,4R,6S)-4,6-diamino-3-[[3-amino-6-(aminomethyl)-3,4-dihydro-2H-pyran-2-yl]oxy]-2-hydroxycyclohexyl]oxy-5-methyl-4-(methylamino)oxane-3,5-diol;sulfuric acid
InChI Key	JVTNJDPXUPRGIE-DAVQCCERSA-N
Molecular Formula	C19H39N5O11S

2,324

DL-Cystine Dihydrochloride, MP Biomedicals™

CAS: 90350-38-2 Molecular Formula: C6H14Cl2N2O4S2 Molecular Weight (g/mol): 313.21 MDL Number: MFCD00084652,MFCD00064228 InChI Key: HHGZUQPEIHGQST-UHFFFAOYNA-N Synonym: cystine dihydrochloride,cytosine-retha-d-riboside hydrochloride,3,3'-disulfanediylbis 2-aminopropanoic acid dihydrochloride,cystinhydrochlorid,cystine,dihydrochloride,dl-cystine hci,acmc-209bj2,dl-cystine dihydrochloride,dl-cystine dihydrochloride crystalline,2-amino-3-2-amino-2-carboxyethyl disulfanyl propanoic acid dihydrochloride PubChem CID: 12297018 IUPAC Name: 2-amino-3-[(2-amino-2-carboxyethyl)disulfanyl]propanoic acid dihydrochloride SMILES: Cl.Cl.NC(CSSCC(N)C(O)=O)C(O)=O

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Specifications

PubChem CID	12297018
CAS	90350-38-2
Molecular Weight (g/mol)	313.21
MDL Number	MFCD00084652,MFCD00064228
SMILES	Cl.Cl.NC(CSSCC(N)C(O)=O)C(O)=O
Synonym	cystine dihydrochloride,cytosine-retha-d-riboside hydrochloride,3,3'-disulfanediylbis 2-aminopropanoic acid dihydrochloride,cystinhydrochlorid,cystine,dihydrochloride,dl-cystine hci,acmc-209bj2,dl-cystine dihydrochloride,dl-cystine dihydrochloride crystalline,2-amino-3-2-amino-2-carboxyethyl disulfanyl propanoic acid dihydrochloride
IUPAC Name	2-amino-3-[(2-amino-2-carboxyethyl)disulfanyl]propanoic acid dihydrochloride
InChI Key	HHGZUQPEIHGQST-UHFFFAOYNA-N
Molecular Formula	C6H14Cl2N2O4S2

2,325

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Perfluoro-2,5,8-trimethyl-3,6,9-trioxadodecanoyl fluoride, 97%

CAS: 27639-98-1 Molecular Formula: C12F24O4 Molecular Weight (g/mol): 664.09 MDL Number: MFCD00084743 InChI Key: IIYQDKPSLAINNX-UHFFFAOYSA-N Synonym: perfluoro-2,5,8-trimethyl-3,6,9-trioxadodecanoyl fluoride,propanoyl fluoride, 2,3,3,3-tetrafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,3,3,3-hexafluoro-2-heptafluoropropoxy propoxy propoxy,2,3,3,3-tetrafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,2,3,3,3-heptafluoropropoxy propoxy propoxy propanoyl fluoride,propanoyl fluoride, 2,3,3,3-tetrafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,2,3,3,3-heptafluoropropoxy propoxy propoxy,propanoyl fluoride,2,3,3,3-tetrafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,2,3,3,3-heptafluoropropoxy propoxy propoxy,acmc-20ajy8,3,6,9-trioxadodecanoyl fluoride, tetradecafluoro-2,5,8-tris trifluoromethyl PubChem CID: 119616 IUPAC Name: 2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propanoyl fluoride SMILES: C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)F

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Specifications

PubChem CID	119616
CAS	27639-98-1
Molecular Weight (g/mol)	664.09
MDL Number	MFCD00084743
SMILES	C(=O)(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(F)F)F)F
Synonym	perfluoro-2,5,8-trimethyl-3,6,9-trioxadodecanoyl fluoride,propanoyl fluoride, 2,3,3,3-tetrafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,3,3,3-hexafluoro-2-heptafluoropropoxy propoxy propoxy,2,3,3,3-tetrafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,2,3,3,3-heptafluoropropoxy propoxy propoxy propanoyl fluoride,propanoyl fluoride, 2,3,3,3-tetrafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,2,3,3,3-heptafluoropropoxy propoxy propoxy,propanoyl fluoride,2,3,3,3-tetrafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,3,3,3-hexafluoro-2-1,1,2,2,3,3,3-heptafluoropropoxy propoxy propoxy,acmc-20ajy8,3,6,9-trioxadodecanoyl fluoride, tetradecafluoro-2,5,8-tris trifluoromethyl
IUPAC Name	2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(1,1,2,2,3,3,3-heptafluoropropoxy)propoxy]propoxy]propanoyl fluoride
InChI Key	IIYQDKPSLAINNX-UHFFFAOYSA-N
Molecular Formula	C12F24O4

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