Lipids and Lipid Derivatives
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(S)-cis-Verbenol, 97%, sum of isomers
CAS: 18881-04-4 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00065444 InChI Key: WONIGEXYPVIKFS-YIZRAAEISA-N Synonym: s-cis-verbenol,verbenol, s-cis,unii-xr9t57f48t,cis-verbenol,bicyclo 3.1.1 hept-3-en-2-ol, 4,6,6-trimethyl-, 1s,2s,5s,1s-cis-verbenol,ccris 5289,?-cis-verbenol PubChem CID: 87839 IUPAC Name: (1S,2S,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-ol SMILES: CC1=CC(C2CC1C2(C)C)O
| PubChem CID | 87839 |
|---|---|
| CAS | 18881-04-4 |
| Molecular Weight (g/mol) | 152.24 |
| MDL Number | MFCD00065444 |
| SMILES | CC1=CC(C2CC1C2(C)C)O |
| Synonym | s-cis-verbenol,verbenol, s-cis,unii-xr9t57f48t,cis-verbenol,bicyclo 3.1.1 hept-3-en-2-ol, 4,6,6-trimethyl-, 1s,2s,5s,1s-cis-verbenol,ccris 5289,?-cis-verbenol |
| IUPAC Name | (1S,2S,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-ol |
| InChI Key | WONIGEXYPVIKFS-YIZRAAEISA-N |
| Molecular Formula | C10H16O |
4-Isopropylbenzonitrile, 95%, Thermo Scientific™
CAS: 13816-33-6 Molecular Formula: C10H11N Molecular Weight (g/mol): 145.205 MDL Number: MFCD00052966 InChI Key: YFDJCWXBKWRDPW-UHFFFAOYSA-N Synonym: 4-isopropylbenzonitrile,cuminyl nitrile,p-cyanocumene,benzonitrile, 4-1-methylethyl,cuminonitrile,cuminic nitrile,p-isopropylbenzonitrile,benzonitrile, p-isopropyl,4-1-methylethyl benzonitrile,4-propan-2-yl benzonitrile PubChem CID: 26289 IUPAC Name: 4-propan-2-ylbenzonitrile SMILES: CC(C)C1=CC=C(C=C1)C#N
| PubChem CID | 26289 |
|---|---|
| CAS | 13816-33-6 |
| Molecular Weight (g/mol) | 145.205 |
| MDL Number | MFCD00052966 |
| SMILES | CC(C)C1=CC=C(C=C1)C#N |
| Synonym | 4-isopropylbenzonitrile,cuminyl nitrile,p-cyanocumene,benzonitrile, 4-1-methylethyl,cuminonitrile,cuminic nitrile,p-isopropylbenzonitrile,benzonitrile, p-isopropyl,4-1-methylethyl benzonitrile,4-propan-2-yl benzonitrile |
| IUPAC Name | 4-propan-2-ylbenzonitrile |
| InChI Key | YFDJCWXBKWRDPW-UHFFFAOYSA-N |
| Molecular Formula | C10H11N |
Barium 2-ethylhexanoate in 2-ethylhexanoic acid, Ba ca 17.5%
CAS: 2457-01-4 Molecular Formula: C16H30BaO4 Molecular Weight (g/mol): 423.74 MDL Number: MFCD00058696 InChI Key: VJFFDDQGMMQGTQ-UHFFFAOYNA-L Synonym: barium 2-ethylhexanoate,barium bis 2-ethylhexanoate,barium 2+ ; 2-ethylhexanoate,hexanoic acid, 2-ethyl-, barium salt 2:1,acmc-20alrk,hexanoic acid, 2-ethyl-, barium salt,dsstox_cid_24888,dsstox_rid_80561,dsstox_gsid_44888,bis 2-ethylhexanoic acid barium salt PubChem CID: 102821 IUPAC Name: barium(2+);2-ethylhexanoate SMILES: CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ba+2]
| PubChem CID | 102821 |
|---|---|
| CAS | 2457-01-4 |
| Molecular Weight (g/mol) | 423.74 |
| MDL Number | MFCD00058696 |
| SMILES | CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Ba+2] |
| Synonym | barium 2-ethylhexanoate,barium bis 2-ethylhexanoate,barium 2+ ; 2-ethylhexanoate,hexanoic acid, 2-ethyl-, barium salt 2:1,acmc-20alrk,hexanoic acid, 2-ethyl-, barium salt,dsstox_cid_24888,dsstox_rid_80561,dsstox_gsid_44888,bis 2-ethylhexanoic acid barium salt |
| IUPAC Name | barium(2+);2-ethylhexanoate |
| InChI Key | VJFFDDQGMMQGTQ-UHFFFAOYNA-L |
| Molecular Formula | C16H30BaO4 |
Methyl cholate, 97%
CAS: 1448-36-8 Molecular Formula: C25H42O5 Molecular Weight (g/mol): 422.606 MDL Number: MFCD00064934 InChI Key: DLYVTEULDNMQAR-BSEHQKOQSA-N Synonym: Cholic acid methyl ester PubChem CID: 133124937 IUPAC Name: methyl (4S)-4-[(3R,7S,8S,9R,10R,12R,13S,14R,17S)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate SMILES: CC(CCC(=O)OC)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C
| PubChem CID | 133124937 |
|---|---|
| CAS | 1448-36-8 |
| Molecular Weight (g/mol) | 422.606 |
| MDL Number | MFCD00064934 |
| SMILES | CC(CCC(=O)OC)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C |
| Synonym | Cholic acid methyl ester |
| IUPAC Name | methyl (4S)-4-[(3R,7S,8S,9R,10R,12R,13S,14R,17S)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate |
| InChI Key | DLYVTEULDNMQAR-BSEHQKOQSA-N |
| Molecular Formula | C25H42O5 |
Squalane, NF, 97-102%, Spectrum™ Chemical
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CAS: 111-01-3 Molecular Formula: C30H62 Molecular Weight (g/mol): 422.83 InChI Key: PRAKJMSDJKAYCZ-UHFFFAOYNA-N IUPAC Name: 2,6,10,15,19,23-hexamethyltetracosane SMILES: CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C
| CAS | 111-01-3 |
|---|---|
| Molecular Weight (g/mol) | 422.83 |
| SMILES | CC(C)CCCC(C)CCCC(C)CCCCC(C)CCCC(C)CCCC(C)C |
| IUPAC Name | 2,6,10,15,19,23-hexamethyltetracosane |
| InChI Key | PRAKJMSDJKAYCZ-UHFFFAOYNA-N |
| Molecular Formula | C30H62 |
Glycerine trioleate, 98%
CAS: 122-32-7 Molecular Formula: C57H104O6 Molecular Weight (g/mol): 885.45 MDL Number: MFCD00137563 InChI Key: PHYFQTYBJUILEZ-BSCDBXJPSA-N Synonym: triolein,glycerol trioleate,glyceryl trioleate,oleic triglyceride,trioleoylglycerol,glycerol triolein,oleic acid triglyceride,trioleoylglyceride,olein,glycerin trioleate PubChem CID: 45253964 IUPAC Name: [2-[(Z)-octadec-9-enoyl]oxy-3-[(E)-octadec-9-enoyl]oxypropyl] (E)-octadec-9-enoate SMILES: CCCCCCCCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCCCCCCCC)OC(=O)CCCCCCCC=CCCCCCCCC
| PubChem CID | 45253964 |
|---|---|
| CAS | 122-32-7 |
| Molecular Weight (g/mol) | 885.45 |
| MDL Number | MFCD00137563 |
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCCCCCCCC)OC(=O)CCCCCCCC=CCCCCCCCC |
| Synonym | triolein,glycerol trioleate,glyceryl trioleate,oleic triglyceride,trioleoylglycerol,glycerol triolein,oleic acid triglyceride,trioleoylglyceride,olein,glycerin trioleate |
| IUPAC Name | [2-[(Z)-octadec-9-enoyl]oxy-3-[(E)-octadec-9-enoyl]oxypropyl] (E)-octadec-9-enoate |
| InChI Key | PHYFQTYBJUILEZ-BSCDBXJPSA-N |
| Molecular Formula | C57H104O6 |
(S)-2-Isobutylsuccinic acid-1-methyl ester, 95%, (98% ee), Thermo Scientific™
CAS: 213270-36-1 Molecular Formula: C9H16O4 Molecular Weight (g/mol): 188.22 MDL Number: MFCD01091033 InChI Key: AJNNFMRCMKGYHA-ZETCQYMHSA-N Synonym: s-3-methoxycarbonyl-5-methylhexanoic acid,s---2-isobutylsuccinic acid 1-methyl ester,3s-3-methoxycarbonyl-5-methylhexanoic acid,s-2-isobutylsuccinic acid 1-methyl ester,s-2-2-methylpropyl butanedioic acid 1-methyl ester,butanedioic acid,2-2-methylpropyl-, 1-methyl ester, 2s PubChem CID: 2734513 IUPAC Name: (3S)-3-methoxycarbonyl-5-methylhexanoic acid SMILES: CC(C)CC(CC(=O)O)C(=O)OC
| PubChem CID | 2734513 |
|---|---|
| CAS | 213270-36-1 |
| Molecular Weight (g/mol) | 188.22 |
| MDL Number | MFCD01091033 |
| SMILES | CC(C)CC(CC(=O)O)C(=O)OC |
| Synonym | s-3-methoxycarbonyl-5-methylhexanoic acid,s---2-isobutylsuccinic acid 1-methyl ester,3s-3-methoxycarbonyl-5-methylhexanoic acid,s-2-isobutylsuccinic acid 1-methyl ester,s-2-2-methylpropyl butanedioic acid 1-methyl ester,butanedioic acid,2-2-methylpropyl-, 1-methyl ester, 2s |
| IUPAC Name | (3S)-3-methoxycarbonyl-5-methylhexanoic acid |
| InChI Key | AJNNFMRCMKGYHA-ZETCQYMHSA-N |
| Molecular Formula | C9H16O4 |
Thermo Scientific Chemicals Flurbiprofen, 98%
CAS: 5104-49-4 Molecular Formula: C15H13FO2 Molecular Weight (g/mol): 244.27 MDL Number: MFCD00079303 InChI Key: SYTBZMRGLBWNTM-UHFFFAOYNA-N Synonym: flurbiprofen,ansaid,froben,antadys,cebutid,flurofen,anside,flurbiprofene,flurbiprofeno,flurbiprofenum PubChem CID: 3394 ChEBI: CHEBI:5130 IUPAC Name: 2-(3-fluoro-4-phenylphenyl)propanoic acid SMILES: CC(C(O)=O)C1=CC=C(C(F)=C1)C1=CC=CC=C1
| PubChem CID | 3394 |
|---|---|
| CAS | 5104-49-4 |
| Molecular Weight (g/mol) | 244.27 |
| ChEBI | CHEBI:5130 |
| MDL Number | MFCD00079303 |
| SMILES | CC(C(O)=O)C1=CC=C(C(F)=C1)C1=CC=CC=C1 |
| Synonym | flurbiprofen,ansaid,froben,antadys,cebutid,flurofen,anside,flurbiprofene,flurbiprofeno,flurbiprofenum |
| IUPAC Name | 2-(3-fluoro-4-phenylphenyl)propanoic acid |
| InChI Key | SYTBZMRGLBWNTM-UHFFFAOYNA-N |
| Molecular Formula | C15H13FO2 |
D-(+)-Camphor, Spectrum™ Chemical
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CAS: 464-49-3
| CAS | 464-49-3 |
|---|
Thermo Scientific Chemicals Vinylacetic acid, tech., 90%, unstabilized
CAS: 625-38-7 Molecular Formula: C4H6O2 Molecular Weight (g/mol): 86.09 MDL Number: MFCD00002782 InChI Key: PVEOYINWKBTPIZ-UHFFFAOYSA-N Synonym: 3-butenoic acid,vinylacetic acid,vinyl acetic acid,acetic acid, ethenyl,beta-butenoic acid,.beta.-butenoic acid,2-propenylcarboxylic acid,allylic acid,vinylessigsaeure,3-butenoicacid PubChem CID: 32743 ChEBI: CHEBI:35897 IUPAC Name: but-3-enoic acid SMILES: OC(=O)CC=C
| PubChem CID | 32743 |
|---|---|
| CAS | 625-38-7 |
| Molecular Weight (g/mol) | 86.09 |
| ChEBI | CHEBI:35897 |
| MDL Number | MFCD00002782 |
| SMILES | OC(=O)CC=C |
| Synonym | 3-butenoic acid,vinylacetic acid,vinyl acetic acid,acetic acid, ethenyl,beta-butenoic acid,.beta.-butenoic acid,2-propenylcarboxylic acid,allylic acid,vinylessigsaeure,3-butenoicacid |
| IUPAC Name | but-3-enoic acid |
| InChI Key | PVEOYINWKBTPIZ-UHFFFAOYSA-N |
| Molecular Formula | C4H6O2 |
2-n-Propylheptanoic acid, 97%
CAS: 31080-39-4 Molecular Formula: C10H20O2 Molecular Weight (g/mol): 172.27 MDL Number: MFCD01723758 InChI Key: RXGPYPPCEXISOV-UHFFFAOYNA-N Synonym: 2-propylheptanic acid,4-nonanecarboxylic acid,heptanoic acid,2-propyl,heptanoic acid, 2-propyl,2-propylheptansaeure german,2-n-propylheptanoic acid,2-n-propyl-1-heptanoic acid,2-propylheptansaeure,2-02-00-00313 beilstein handbook reference PubChem CID: 35728 IUPAC Name: 2-propylheptanoic acid SMILES: CCCCCC(CCC)C(O)=O
| PubChem CID | 35728 |
|---|---|
| CAS | 31080-39-4 |
| Molecular Weight (g/mol) | 172.27 |
| MDL Number | MFCD01723758 |
| SMILES | CCCCCC(CCC)C(O)=O |
| Synonym | 2-propylheptanic acid,4-nonanecarboxylic acid,heptanoic acid,2-propyl,heptanoic acid, 2-propyl,2-propylheptansaeure german,2-n-propylheptanoic acid,2-n-propyl-1-heptanoic acid,2-propylheptansaeure,2-02-00-00313 beilstein handbook reference |
| IUPAC Name | 2-propylheptanoic acid |
| InChI Key | RXGPYPPCEXISOV-UHFFFAOYNA-N |
| Molecular Formula | C10H20O2 |
Thermo Scientific Chemicals Finasteride, 98%
CAS: 98319-26-7 Molecular Formula: C23H36N2O2 Molecular Weight (g/mol): 372.54 InChI Key: DBEPLOCGEIEOCV-WSBQPABSSA-N Synonym: finasteride,proscar,propecia,finastid,prostide,chibro-proscar,finasterida,finasteridum,finpecia,finasteridum inn-latin PubChem CID: 57363 ChEBI: CHEBI:5062 IUPAC Name: (1S,3aS,3bS,5aR,9aR,9bS,11aS)-N-tert-butyl-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide SMILES: CC12CCC3C(C1CCC2C(=O)NC(C)(C)C)CCC4C3(C=CC(=O)N4)C
| PubChem CID | 57363 |
|---|---|
| CAS | 98319-26-7 |
| Molecular Weight (g/mol) | 372.54 |
| ChEBI | CHEBI:5062 |
| SMILES | CC12CCC3C(C1CCC2C(=O)NC(C)(C)C)CCC4C3(C=CC(=O)N4)C |
| Synonym | finasteride,proscar,propecia,finastid,prostide,chibro-proscar,finasterida,finasteridum,finpecia,finasteridum inn-latin |
| IUPAC Name | (1S,3aS,3bS,5aR,9aR,9bS,11aS)-N-tert-butyl-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide |
| InChI Key | DBEPLOCGEIEOCV-WSBQPABSSA-N |
| Molecular Formula | C23H36N2O2 |
3-(2,2,3-Trimethylnorborn-5-yl)cyclohexyl acrylate
CAS: 903876-45-9 Molecular Formula: C19H30O2 Molecular Weight (g/mol): 290.45 MDL Number: MFCD22380703 InChI Key: CDBRNGRSVNBVLJ-UHFFFAOYNA-N Synonym: 3-5,5,6-trimethylbicyclo 2.2.1 heptan-2-yl cyclohexyl prop-2-enoate
| CAS | 903876-45-9 |
|---|---|
| Molecular Weight (g/mol) | 290.45 |
| MDL Number | MFCD22380703 |
| Synonym | 3-5,5,6-trimethylbicyclo 2.2.1 heptan-2-yl cyclohexyl prop-2-enoate |
| InChI Key | CDBRNGRSVNBVLJ-UHFFFAOYNA-N |
| Molecular Formula | C19H30O2 |
4-Bromobutyric acid, 97%
CAS: 2623-87-2 Molecular Formula: C4H7BrO2 Molecular Weight (g/mol): 167.00 MDL Number: MFCD00002817 InChI Key: GRHQDJDRGZFIPO-UHFFFAOYSA-N Synonym: 4-bromobutyric acid,butanoic acid, 4-bromo,4-bromo-n-butyric acid,butyric acid, 4-bromo,gamma-bromobutyric acid,rarechem al bo 0176,4-bromobutyricacid,carboxypropyl bromide,4-bromo-butyric acid,pubchem3754 PubChem CID: 75809 IUPAC Name: 4-bromobutanoic acid SMILES: OC(=O)CCCBr
| PubChem CID | 75809 |
|---|---|
| CAS | 2623-87-2 |
| Molecular Weight (g/mol) | 167.00 |
| MDL Number | MFCD00002817 |
| SMILES | OC(=O)CCCBr |
| Synonym | 4-bromobutyric acid,butanoic acid, 4-bromo,4-bromo-n-butyric acid,butyric acid, 4-bromo,gamma-bromobutyric acid,rarechem al bo 0176,4-bromobutyricacid,carboxypropyl bromide,4-bromo-butyric acid,pubchem3754 |
| IUPAC Name | 4-bromobutanoic acid |
| InChI Key | GRHQDJDRGZFIPO-UHFFFAOYSA-N |
| Molecular Formula | C4H7BrO2 |
Monomethyl Itaconate, Spectrum™ Chemical
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CAS: 7338-27-4 Molecular Weight (g/mol): 144.13 g/mol
| CAS | 7338-27-4 |
|---|---|
| Molecular Weight (g/mol) | 144.13 g/mol |