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Fatty acid conjugates

Positional and geometric isomers of fatty acids with conjugated double bonds; implies four consecutive unsaturated links, and results in a delocalization of electrons along the double-bonded carbons; available in carbon chains of varying length.

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1

12-Hydroxystearic acid, 95%

CAS: 106-14-9 Molecular Formula: C18H36O3 Molecular Weight (g/mol): 300.483 MDL Number: MFCD00004592 InChI Key: ULQISTXYYBZJSJ-UHFFFAOYSA-N Synonym: 12-hydroxystearic acid,octadecanoic acid, 12-hydroxy,harwax a,cerit fac 3,hydrofol acid 200,dl-12-hydroxystearic acid,ceroxin gl,barolub fto,loxiol g 21,stearic acid, 12-hydroxy PubChem CID: 7789 ChEBI: CHEBI:85208 IUPAC Name: 12-hydroxyoctadecanoic acid SMILES: CCCCCCC(CCCCCCCCCCC(=O)O)O

PubChem CID 7789
CAS 106-14-9
Molecular Weight (g/mol) 300.483
ChEBI CHEBI:85208
MDL Number MFCD00004592
SMILES CCCCCCC(CCCCCCCCCCC(=O)O)O
Synonym 12-hydroxystearic acid,octadecanoic acid, 12-hydroxy,harwax a,cerit fac 3,hydrofol acid 200,dl-12-hydroxystearic acid,ceroxin gl,barolub fto,loxiol g 21,stearic acid, 12-hydroxy
IUPAC Name 12-hydroxyoctadecanoic acid
InChI Key ULQISTXYYBZJSJ-UHFFFAOYSA-N
Molecular Formula C18H36O3
2

12-Hydroxystearic acid, tech. 85%

CAS: 106-14-9 Molecular Formula: C18H36O3 Molecular Weight (g/mol): 300.483 MDL Number: MFCD00004592 InChI Key: ULQISTXYYBZJSJ-UHFFFAOYSA-N Synonym: 12-hydroxystearic acid,octadecanoic acid, 12-hydroxy,harwax a,cerit fac 3,hydrofol acid 200,dl-12-hydroxystearic acid,ceroxin gl,barolub fto,loxiol g 21,stearic acid, 12-hydroxy PubChem CID: 7789 ChEBI: CHEBI:85208 IUPAC Name: 12-hydroxyoctadecanoic acid SMILES: CCCCCCC(CCCCCCCCCCC(=O)O)O

PubChem CID 7789
CAS 106-14-9
Molecular Weight (g/mol) 300.483
ChEBI CHEBI:85208
MDL Number MFCD00004592
SMILES CCCCCCC(CCCCCCCCCCC(=O)O)O
Synonym 12-hydroxystearic acid,octadecanoic acid, 12-hydroxy,harwax a,cerit fac 3,hydrofol acid 200,dl-12-hydroxystearic acid,ceroxin gl,barolub fto,loxiol g 21,stearic acid, 12-hydroxy
IUPAC Name 12-hydroxyoctadecanoic acid
InChI Key ULQISTXYYBZJSJ-UHFFFAOYSA-N
Molecular Formula C18H36O3
3

Retinoic acid, 97%

CAS: 302-79-4 Molecular Formula: C20H28O2 Molecular Weight (g/mol): 300.44 MDL Number: MFCD00001551 InChI Key: SHGAZHPCJJPHSC-YCNIQYBTSA-N Synonym: retinoic acid,tretinoin,vitamin a acid,all-trans-retinoic acid,trans-retinoic acid,renova,airol,retin-a,vesanoid,atra PubChem CID: 444795 ChEBI: CHEBI:15367 SMILES: C\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(/C)=C/C(O)=O

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PubChem CID 444795
CAS 302-79-4
Molecular Weight (g/mol) 300.44
ChEBI CHEBI:15367
MDL Number MFCD00001551
SMILES C\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(/C)=C/C(O)=O
Synonym retinoic acid,tretinoin,vitamin a acid,all-trans-retinoic acid,trans-retinoic acid,renova,airol,retin-a,vesanoid,atra
InChI Key SHGAZHPCJJPHSC-YCNIQYBTSA-N
Molecular Formula C20H28O2
4

Sorbic acid, 99%

CAS: 110-44-1 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.13 MDL Number: MFCD00002703 InChI Key: WSWCOQWTEOXDQX-MQQKCMAXSA-N Synonym: sorbic acid,2,4-hexadienoic acid,2e,4e-hexa-2,4-dienoic acid,2e,4e-hexadienoic acid,panosorb,2-propenylacrylic acid,trans,trans-sorbic acid,sorbistat,hexadienoic acid,e,e-2,4-hexadienoic acid PubChem CID: 643460 ChEBI: CHEBI:38358 IUPAC Name: (2E,4E)-hexa-2,4-dienoic acid SMILES: C\C=C\C=C\C(O)=O

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PubChem CID 643460
CAS 110-44-1
Molecular Weight (g/mol) 112.13
ChEBI CHEBI:38358
MDL Number MFCD00002703
SMILES C\C=C\C=C\C(O)=O
Synonym sorbic acid,2,4-hexadienoic acid,2e,4e-hexa-2,4-dienoic acid,2e,4e-hexadienoic acid,panosorb,2-propenylacrylic acid,trans,trans-sorbic acid,sorbistat,hexadienoic acid,e,e-2,4-hexadienoic acid
IUPAC Name (2E,4E)-hexa-2,4-dienoic acid
InChI Key WSWCOQWTEOXDQX-MQQKCMAXSA-N
Molecular Formula C6H8O2
5
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Fumaric acid, 99+%

CAS: 110-17-8 Molecular Formula: C4H4O4 Molecular Weight (g/mol): 116.07 MDL Number: MFCD00002700 InChI Key: VZCYOOQTPOCHFL-OWOJBTEDSA-N Synonym: fumaric acid,2-butenedioic acid,trans-butenedioic acid,allomaleic acid,boletic acid,lichenic acid,tumaric acid,2e-but-2-enedioic acid,butenedioic acid,trans-2-butenedioic acid PubChem CID: 444972 ChEBI: CHEBI:18012 SMILES: OC(=O)\C=C\C(O)=O

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PubChem CID 444972
CAS 110-17-8
Molecular Weight (g/mol) 116.07
ChEBI CHEBI:18012
MDL Number MFCD00002700
SMILES OC(=O)\C=C\C(O)=O
Synonym fumaric acid,2-butenedioic acid,trans-butenedioic acid,allomaleic acid,boletic acid,lichenic acid,tumaric acid,2e-but-2-enedioic acid,butenedioic acid,trans-2-butenedioic acid
InChI Key VZCYOOQTPOCHFL-OWOJBTEDSA-N
Molecular Formula C4H4O4
6

6-Aminohexanoic acid, 99%

CAS: 60-32-2 Molecular Formula: C6H13NO2 Molecular Weight (g/mol): 131.175 MDL Number: MFCD00008238 InChI Key: SLXKOJJOQWFEFD-UHFFFAOYSA-N Synonym: 6-aminocaproic acid,aminocaproic acid,amicar,epsikapron,capramol,caprocid,epsamon,eaca,acepramin,caprolisin PubChem CID: 564 ChEBI: CHEBI:16586 IUPAC Name: 6-aminohexanoic acid SMILES: C(CCC(=O)O)CCN

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PubChem CID 564
CAS 60-32-2
Molecular Weight (g/mol) 131.175
ChEBI CHEBI:16586
MDL Number MFCD00008238
SMILES C(CCC(=O)O)CCN
Synonym 6-aminocaproic acid,aminocaproic acid,amicar,epsikapron,capramol,caprocid,epsamon,eaca,acepramin,caprolisin
IUPAC Name 6-aminohexanoic acid
InChI Key SLXKOJJOQWFEFD-UHFFFAOYSA-N
Molecular Formula C6H13NO2
7

Thermo Scientific Chemicals Linoleic acid, 70%

CAS: 60-33-3 Molecular Formula: C18H32O2 Molecular Weight (g/mol): 280.45 MDL Number: MFCD00064241 InChI Key: OYHQOLUKZRVURQ-HZJYTTRNSA-N Synonym: linoleic acid,linolic acid,telfairic acid,cis,cis-linoleic acid,9z,12z-octadeca-9,12-dienoic acid,linoleate,grape seed oil,cis,cis-9,12-octadecadienoic acid,cis-9,cis-12-octadecadienoic acid,9z,12z-linoleic acid PubChem CID: 5280450 ChEBI: CHEBI:17351 IUPAC Name: (9Z,12Z)-octadeca-9,12-dienoic acid SMILES: CCCCCC=CCC=CCCCCCCCC(=O)O

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PubChem CID 5280450
CAS 60-33-3
Molecular Weight (g/mol) 280.45
ChEBI CHEBI:17351
MDL Number MFCD00064241
SMILES CCCCCC=CCC=CCCCCCCCC(=O)O
Synonym linoleic acid,linolic acid,telfairic acid,cis,cis-linoleic acid,9z,12z-octadeca-9,12-dienoic acid,linoleate,grape seed oil,cis,cis-9,12-octadecadienoic acid,cis-9,cis-12-octadecadienoic acid,9z,12z-linoleic acid
IUPAC Name (9Z,12Z)-octadeca-9,12-dienoic acid
InChI Key OYHQOLUKZRVURQ-HZJYTTRNSA-N
Molecular Formula C18H32O2
8

Thermo Scientific Chemicals Lauric acid, 99%

CAS: 143-07-7 Molecular Formula: C12H24O2 Molecular Weight (g/mol): 200.32 MDL Number: MFCD00002736 InChI Key: POULHZVOKOAJMA-UHFFFAOYSA-N Synonym: lauric acid,n-dodecanoic acid,dodecylic acid,vulvic acid,laurostearic acid,dodecoic acid,duodecylic acid,1-undecanecarboxylic acid,aliphat no. 4,neo-fat 12 PubChem CID: 3893 ChEBI: CHEBI:30805 IUPAC Name: dodecanoic acid SMILES: CCCCCCCCCCCC(=O)O

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PubChem CID 3893
CAS 143-07-7
Molecular Weight (g/mol) 200.32
ChEBI CHEBI:30805
MDL Number MFCD00002736
SMILES CCCCCCCCCCCC(=O)O
Synonym lauric acid,n-dodecanoic acid,dodecylic acid,vulvic acid,laurostearic acid,dodecoic acid,duodecylic acid,1-undecanecarboxylic acid,aliphat no. 4,neo-fat 12
IUPAC Name dodecanoic acid
InChI Key POULHZVOKOAJMA-UHFFFAOYSA-N
Molecular Formula C12H24O2
9

Itaconic acid, 99%

CAS: 97-65-4 Molecular Formula: C5H6O4 Molecular Weight (g/mol): 130.099 MDL Number: MFCD00004260 InChI Key: LVHBHZANLOWSRM-UHFFFAOYSA-N Synonym: itaconic acid,2-methylenesuccinic acid,methylenesuccinic acid,methylenebutanedioic acid,propylenedicarboxylic acid,itaconate,2-propene-1,2-dicarboxylic acid,butanedioic acid, methylene,succinic acid, methylene,2-methylenebutanedioic acid PubChem CID: 811 ChEBI: CHEBI:30838 IUPAC Name: 2-methylidenebutanedioic acid SMILES: C=C(CC(=O)O)C(=O)O

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PubChem CID 811
CAS 97-65-4
Molecular Weight (g/mol) 130.099
ChEBI CHEBI:30838
MDL Number MFCD00004260
SMILES C=C(CC(=O)O)C(=O)O
Synonym itaconic acid,2-methylenesuccinic acid,methylenesuccinic acid,methylenebutanedioic acid,propylenedicarboxylic acid,itaconate,2-propene-1,2-dicarboxylic acid,butanedioic acid, methylene,succinic acid, methylene,2-methylenebutanedioic acid
IUPAC Name 2-methylidenebutanedioic acid
InChI Key LVHBHZANLOWSRM-UHFFFAOYSA-N
Molecular Formula C5H6O4
10

Undecanoic acid, 98%

CAS: 112-37-8 Molecular Formula: C11H22O2 Molecular Weight (g/mol): 186.295 MDL Number: MFCD00002730 InChI Key: ZDPHROOEEOARMN-UHFFFAOYSA-N Synonym: hendecanoic acid,undecylic acid,n-undecanoic acid,n-undecoic acid,n-undecylic acid,undecoic acid,undecanoate,1-decanecarboxylic acid,undekansaeure,unii-138on3iiqg PubChem CID: 8180 ChEBI: CHEBI:32368 IUPAC Name: undecanoic acid SMILES: CCCCCCCCCCC(=O)O

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PubChem CID 8180
CAS 112-37-8
Molecular Weight (g/mol) 186.295
ChEBI CHEBI:32368
MDL Number MFCD00002730
SMILES CCCCCCCCCCC(=O)O
Synonym hendecanoic acid,undecylic acid,n-undecanoic acid,n-undecoic acid,n-undecylic acid,undecoic acid,undecanoate,1-decanecarboxylic acid,undekansaeure,unii-138on3iiqg
IUPAC Name undecanoic acid
InChI Key ZDPHROOEEOARMN-UHFFFAOYSA-N
Molecular Formula C11H22O2
11

Itaconic acid, 99+%

CAS: 97-65-4 Molecular Formula: C5H6O4 Molecular Weight (g/mol): 130.1 InChI Key: LVHBHZANLOWSRM-UHFFFAOYSA-N Synonym: itaconic acid,2-methylenesuccinic acid,methylenesuccinic acid,methylenebutanedioic acid,propylenedicarboxylic acid,itaconate,2-propene-1,2-dicarboxylic acid,butanedioic acid, methylene,succinic acid, methylene,2-methylenebutanedioic acid PubChem CID: 811 ChEBI: CHEBI:30838 IUPAC Name: 2-methylidenebutanedioic acid SMILES: C=C(CC(=O)O)C(=O)O

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PubChem CID 811
CAS 97-65-4
Molecular Weight (g/mol) 130.1
ChEBI CHEBI:30838
SMILES C=C(CC(=O)O)C(=O)O
Synonym itaconic acid,2-methylenesuccinic acid,methylenesuccinic acid,methylenebutanedioic acid,propylenedicarboxylic acid,itaconate,2-propene-1,2-dicarboxylic acid,butanedioic acid, methylene,succinic acid, methylene,2-methylenebutanedioic acid
IUPAC Name 2-methylidenebutanedioic acid
InChI Key LVHBHZANLOWSRM-UHFFFAOYSA-N
Molecular Formula C5H6O4
12

Nonanoic acid, 97%

CAS: 112-05-0 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.241 MDL Number: MFCD00004433 InChI Key: FBUKVWPVBMHYJY-UHFFFAOYSA-N Synonym: pelargonic acid,n-nonanoic acid,nonylic acid,pelargic acid,nonoic acid,n-nonylic acid,n-nonoic acid,1-octanecarboxylic acid,pelargon,cirrasol 185a PubChem CID: 8158 ChEBI: CHEBI:29019 IUPAC Name: nonanoic acid SMILES: CCCCCCCCC(=O)O

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PubChem CID 8158
CAS 112-05-0
Molecular Weight (g/mol) 158.241
ChEBI CHEBI:29019
MDL Number MFCD00004433
SMILES CCCCCCCCC(=O)O
Synonym pelargonic acid,n-nonanoic acid,nonylic acid,pelargic acid,nonoic acid,n-nonylic acid,n-nonoic acid,1-octanecarboxylic acid,pelargon,cirrasol 185a
IUPAC Name nonanoic acid
InChI Key FBUKVWPVBMHYJY-UHFFFAOYSA-N
Molecular Formula C9H18O2
13

Oleic acid, 99%

CAS: 112-80-1 Molecular Formula: C18H34O2 Molecular Weight (g/mol): 282.47 MDL Number: MFCD00064242 InChI Key: ZQPPMHVWECSIRJ-MDZDMXLPSA-N Synonym: oleic acid,cis-9-octadecenoic acid,cis-oleic acid,elaidoic acid,oleate,glycon wo,wecoline oo,pamolyn 100,glycon ro,z-octadec-9-enoic acid PubChem CID: 445639 ChEBI: CHEBI:16196 IUPAC Name: (Z)-octadec-9-enoic acid SMILES: CCCCCCCC\C=C\CCCCCCCC(O)=O

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PubChem CID 445639
CAS 112-80-1
Molecular Weight (g/mol) 282.47
ChEBI CHEBI:16196
MDL Number MFCD00064242
SMILES CCCCCCCC\C=C\CCCCCCCC(O)=O
Synonym oleic acid,cis-9-octadecenoic acid,cis-oleic acid,elaidoic acid,oleate,glycon wo,wecoline oo,pamolyn 100,glycon ro,z-octadec-9-enoic acid
IUPAC Name (Z)-octadec-9-enoic acid
InChI Key ZQPPMHVWECSIRJ-MDZDMXLPSA-N
Molecular Formula C18H34O2
14

Fumaric acid, 99%

CAS: 110-17-8 Molecular Formula: C4H4O4 Molecular Weight (g/mol): 116.07 MDL Number: MFCD00002700 InChI Key: VZCYOOQTPOCHFL-OWOJBTEDSA-N Synonym: fumaric acid,2-butenedioic acid,trans-butenedioic acid,allomaleic acid,boletic acid,lichenic acid,tumaric acid,2e-but-2-enedioic acid,butenedioic acid,trans-2-butenedioic acid PubChem CID: 444972 ChEBI: CHEBI:18012 IUPAC Name: (E)-but-2-enedioic acid SMILES: OC(=O)\C=C\C(O)=O

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PubChem CID 444972
CAS 110-17-8
Molecular Weight (g/mol) 116.07
ChEBI CHEBI:18012
MDL Number MFCD00002700
SMILES OC(=O)\C=C\C(O)=O
Synonym fumaric acid,2-butenedioic acid,trans-butenedioic acid,allomaleic acid,boletic acid,lichenic acid,tumaric acid,2e-but-2-enedioic acid,butenedioic acid,trans-2-butenedioic acid
IUPAC Name (E)-but-2-enedioic acid
InChI Key VZCYOOQTPOCHFL-OWOJBTEDSA-N
Molecular Formula C4H4O4
15

Sebacic Acid, 98%

CAS: 111-20-6 Molecular Formula: C10H18O4 Molecular Weight (g/mol): 202.25 MDL Number: MFCD00004440 InChI Key: CXMXRPHRNRROMY-UHFFFAOYSA-N Synonym: sebacic acid,1,8-octanedicarboxylic acid,1,10-decanedioic acid,sebacic acids,decanedicarboxylic acid,n-decanedioic acid,sebacinsaure,acide sebacique,sebacate,sebacinsaeure PubChem CID: 5192 ChEBI: CHEBI:41865 IUPAC Name: decanedioic acid SMILES: C(CCCCC(=O)O)CCCC(=O)O

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PubChem CID 5192
CAS 111-20-6
Molecular Weight (g/mol) 202.25
ChEBI CHEBI:41865
MDL Number MFCD00004440
SMILES C(CCCCC(=O)O)CCCC(=O)O
Synonym sebacic acid,1,8-octanedicarboxylic acid,1,10-decanedioic acid,sebacic acids,decanedicarboxylic acid,n-decanedioic acid,sebacinsaure,acide sebacique,sebacate,sebacinsaeure
IUPAC Name decanedioic acid
InChI Key CXMXRPHRNRROMY-UHFFFAOYSA-N
Molecular Formula C10H18O4