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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46 – 60 of 2,238 results

Oleic acid, sodium salt, 65-90% oleic C18

CAS: 143-19-1 Molecular Formula: C₁₈H₃₃NaO₂ Molecular Weight (g/mol): 304.44 MDL Number: MFCD00004438 InChI Key: BCKXLBQYZLBQEK-KVVVOXFISA-M Synonym: sodium oleic acid PubChem CID: 23665730 ChEBI: CHEBI:81860 IUPAC Name: sodium;(Z)-octadec-9-enoate SMILES: CCCCCCCCC=CCCCCCCCC(=O)[O-].[Na+]

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Specifications

PubChem CID	23665730
CAS	143-19-1
Molecular Weight (g/mol)	304.44
ChEBI	CHEBI:81860
MDL Number	MFCD00004438
SMILES	CCCCCCCCC=CCCCCCCCC(=O)[O-].[Na+]
Synonym	sodium oleic acid
IUPAC Name	sodium;(Z)-octadec-9-enoate
InChI Key	BCKXLBQYZLBQEK-KVVVOXFISA-M
Molecular Formula	C₁₈H₃₃NaO₂

3,5,5-Trimethylhexanoic acid, 97%

CAS: 3302-10-1 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.24 MDL Number: MFCD00020507 InChI Key: OILUAKBAMVLXGF-UHFFFAOYNA-N Synonym: hexanoic acid, 3,5,5-trimethyl,3,5,5-trimethyl-hexanoic acid,3,5,5-trimethylhexanoicacid,unii-aw943q219o,acmc-1assi,dsstox_cid_9254,3,5-trimethylhexanoic acid,dsstox_rid_78735,dsstox_gsid_29254,3,5,5 trimethylhexanoic acid PubChem CID: 90960 IUPAC Name: 3,5,5-trimethylhexanoic acid SMILES: CC(CC(=O)O)CC(C)(C)C

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Specifications

PubChem CID	90960
CAS	3302-10-1
Molecular Weight (g/mol)	158.24
MDL Number	MFCD00020507
SMILES	CC(CC(=O)O)CC(C)(C)C
Synonym	hexanoic acid, 3,5,5-trimethyl,3,5,5-trimethyl-hexanoic acid,3,5,5-trimethylhexanoicacid,unii-aw943q219o,acmc-1assi,dsstox_cid_9254,3,5-trimethylhexanoic acid,dsstox_rid_78735,dsstox_gsid_29254,3,5,5 trimethylhexanoic acid
IUPAC Name	3,5,5-trimethylhexanoic acid
InChI Key	OILUAKBAMVLXGF-UHFFFAOYNA-N
Molecular Formula	C9H18O2

4-Pentenoic acid, 99%

CAS: 591-80-0 Molecular Formula: C5H8O2 Molecular Weight (g/mol): 100.12 MDL Number: MFCD00004408 InChI Key: HVAMZGADVCBITI-UHFFFAOYSA-N Synonym: 4-pentenoic acid,allylacetic acid,allyl acetic acid,4 pa,3-vinylpropionic acid,delta 4-pentenoic acid,unii-d4s77y29fb,fema no. 2843,.delta.4-pentenoic acid,wln: qv3u1 PubChem CID: 61138 ChEBI: CHEBI:35936 IUPAC Name: pent-4-enoic acid SMILES: OC(=O)CCC=C

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Specifications

PubChem CID	61138
CAS	591-80-0
Molecular Weight (g/mol)	100.12
ChEBI	CHEBI:35936
MDL Number	MFCD00004408
SMILES	OC(=O)CCC=C
Synonym	4-pentenoic acid,allylacetic acid,allyl acetic acid,4 pa,3-vinylpropionic acid,delta 4-pentenoic acid,unii-d4s77y29fb,fema no. 2843,.delta.4-pentenoic acid,wln: qv3u1
IUPAC Name	pent-4-enoic acid
InChI Key	HVAMZGADVCBITI-UHFFFAOYSA-N
Molecular Formula	C5H8O2

Oleic acid, 99%, MP Biomedicals™

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: (9E)-octadec-9-enoic acid SMILES: CCCCCCCC\C=C\CCCCCCCC(O)=O

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Specifications

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	(9E)-octadec-9-enoic acid
InChI Key	ZQPPMHVWECSIRJ-MDZDMXLPSA-N
Molecular Formula	C18H34O2

Palmitic Acid, >99%, MP Biomedicals™

CAS: 57-10-3 Molecular Formula: C16H32O2 Molecular Weight (g/mol): 256.43 MDL Number: MFCD00002747 InChI Key: IPCSVZSSVZVIGE-UHFFFAOYSA-N Synonym: palmitic acid,cetylic acid,palmitate,n-hexadecanoic acid,hexadecylic acid,hydrofol,n-hexadecoic acid,1-pentadecanecarboxylic acid,palmitinic acid,pentadecanecarboxylic acid PubChem CID: 985 ChEBI: CHEBI:15756 IUPAC Name: hexadecanoic acid SMILES: CCCCCCCCCCCCCCCC(O)=O

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PubChem CID	985
CAS	57-10-3
Molecular Weight (g/mol)	256.43
ChEBI	CHEBI:15756
MDL Number	MFCD00002747
SMILES	CCCCCCCCCCCCCCCC(O)=O
Synonym	palmitic acid,cetylic acid,palmitate,n-hexadecanoic acid,hexadecylic acid,hydrofol,n-hexadecoic acid,1-pentadecanecarboxylic acid,palmitinic acid,pentadecanecarboxylic acid
IUPAC Name	hexadecanoic acid
InChI Key	IPCSVZSSVZVIGE-UHFFFAOYSA-N
Molecular Formula	C16H32O2

trans-Crotonic acid, 98%

CAS: 107-93-7 Molecular Formula: C4H6O2 Molecular Weight (g/mol): 86.09 MDL Number: MFCD00002701 InChI Key: LDHQCZJRKDOVOX-NSCUHMNNSA-N Synonym: crotonic acid,e-but-2-enoic acid,but-2-enoic acid,trans-2-butenoic acid,trans-crotonic acid,3-methylacrylic acid,e-2-butenoic acid,2-butenoic acid,2e-but-2-enoic acid,e-crotonic acid PubChem CID: 637090 ChEBI: CHEBI:41131 IUPAC Name: (E)-but-2-enoic acid SMILES: CC=CC(=O)O

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Specifications

PubChem CID	637090
CAS	107-93-7
Molecular Weight (g/mol)	86.09
ChEBI	CHEBI:41131
MDL Number	MFCD00002701
SMILES	CC=CC(=O)O
Synonym	crotonic acid,e-but-2-enoic acid,but-2-enoic acid,trans-2-butenoic acid,trans-crotonic acid,3-methylacrylic acid,e-2-butenoic acid,2-butenoic acid,2e-but-2-enoic acid,e-crotonic acid
IUPAC Name	(E)-but-2-enoic acid
InChI Key	LDHQCZJRKDOVOX-NSCUHMNNSA-N
Molecular Formula	C4H6O2

n-Nonanoic acid, 97%

CAS: 112-05-0 Molecular Formula: C₉H₁₈O₂ Molecular Weight (g/mol): 158.24 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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Specifications

PubChem CID	8158
CAS	112-05-0
Molecular Weight (g/mol)	158.24
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

10-Undecenoic acid, 99%

CAS: 112-38-9 Molecular Formula: C11H20O2 Molecular Weight (g/mol): 184.279 MDL Number: MFCD00004442 InChI Key: FRPZMMHWLSIFAZ-UHFFFAOYSA-N Synonym: 10-undecenoic acid,undecylenic acid,desenex,10-hendecenoic acid,renselin,declid,sevinon,10-undecylenic acid,9-undecylenic acid,undecyl-10-enic acid PubChem CID: 5634 ChEBI: CHEBI:35045 IUPAC Name: undec-10-enoic acid SMILES: C=CCCCCCCCCC(=O)O

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Specifications

PubChem CID	5634
CAS	112-38-9
Molecular Weight (g/mol)	184.279
ChEBI	CHEBI:35045
MDL Number	MFCD00004442
SMILES	C=CCCCCCCCCC(=O)O
Synonym	10-undecenoic acid,undecylenic acid,desenex,10-hendecenoic acid,renselin,declid,sevinon,10-undecylenic acid,9-undecylenic acid,undecyl-10-enic acid
IUPAC Name	undec-10-enoic acid
InChI Key	FRPZMMHWLSIFAZ-UHFFFAOYSA-N
Molecular Formula	C11H20O2

trans,trans-1,3-Butadiene-1,4-dicarboxylic acid, 98%

CAS: 3588-17-8 Molecular Formula: C6H6O4 Molecular Weight (g/mol): 142.11 MDL Number: MFCD00002702 InChI Key: TXXHDPDFNKHHGW-ZPUQHVIOSA-N Synonym: trans,trans-muconic acid,muconic acid,e,e-muconic acid,2,4-hexadienedioic acid,trans, trans-muconic acid,hexa-2,4-dienedioic acid,2e,4e-hexa-2,4-dienedioic acid,1,3-butadiene-1,4-dicarboxylic acid,2,4-hexadienedioic acid, e,e,trans,trans-2,4-hexadienedioic acid PubChem CID: 5356793 ChEBI: CHEBI:27036 IUPAC Name: (2E,4E)-hexa-2,4-dienedioic acid SMILES: C(=CC(=O)O)C=CC(=O)O

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Specifications

PubChem CID	5356793
CAS	3588-17-8
Molecular Weight (g/mol)	142.11
ChEBI	CHEBI:27036
MDL Number	MFCD00002702
SMILES	C(=CC(=O)O)C=CC(=O)O
Synonym	trans,trans-muconic acid,muconic acid,e,e-muconic acid,2,4-hexadienedioic acid,trans, trans-muconic acid,hexa-2,4-dienedioic acid,2e,4e-hexa-2,4-dienedioic acid,1,3-butadiene-1,4-dicarboxylic acid,2,4-hexadienedioic acid, e,e,trans,trans-2,4-hexadienedioic acid
IUPAC Name	(2E,4E)-hexa-2,4-dienedioic acid
InChI Key	TXXHDPDFNKHHGW-ZPUQHVIOSA-N
Molecular Formula	C6H6O4

Mycophenolic Acid, MP Biomedicals

CAS: 24280-93-1 Molecular Formula: C17H20O6 Molecular Weight (g/mol): 320.341 MDL Number: MFCD00036814 InChI Key: HPNSFSBZBAHARI-RUDMXATFSA-N Synonym: mycophenolic acid,mycophenolate,melbex,myfortic,mycophenolsaeure,acido micofenolico,micofenolico acido,acide mycophenolique,acidum mycophenolicum,6-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl-4-methyl-4-hexenoic acid PubChem CID: 446541 ChEBI: CHEBI:168396 IUPAC Name: (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid SMILES: CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)O)OC

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Specifications

PubChem CID	446541
CAS	24280-93-1
Molecular Weight (g/mol)	320.341
ChEBI	CHEBI:168396
MDL Number	MFCD00036814
SMILES	CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)O)OC
Synonym	mycophenolic acid,mycophenolate,melbex,myfortic,mycophenolsaeure,acido micofenolico,micofenolico acido,acide mycophenolique,acidum mycophenolicum,6-4-hydroxy-6-methoxy-7-methyl-3-oxo-5-phthalanyl-4-methyl-4-hexenoic acid
IUPAC Name	(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid
InChI Key	HPNSFSBZBAHARI-RUDMXATFSA-N
Molecular Formula	C17H20O6

PubChem CID	985
CAS	57-10-3
Molecular Weight (g/mol)	256.43
ChEBI	CHEBI:15756
MDL Number	MFCD00002747
SMILES	CCCCCCCCCCCCCCCC(O)=O
Synonym	palmitic acid,cetylic acid,palmitate,n-hexadecanoic acid,hexadecylic acid,hydrofol,n-hexadecoic acid,1-pentadecanecarboxylic acid,palmitinic acid,pentadecanecarboxylic acid
IUPAC Name	hexadecanoic acid
InChI Key	IPCSVZSSVZVIGE-UHFFFAOYSA-N
Molecular Formula	C16H32O2

Tetradecanoic acid, 98%

CAS: 544-63-8 Molecular Formula: C14H28O2 Molecular Weight (g/mol): 228.38 MDL Number: MFCD00002744 InChI Key: TUNFSRHWOTWDNC-UHFFFAOYSA-N Synonym: myristic acid,n-tetradecanoic acid,n-tetradecoic acid,crodacid,n-tetradecan-1-oic acid,1-tridecanecarboxylic acid,hydrofol acid 1495,univol u 316s,emery 655,myristinsaeure PubChem CID: 11005 ChEBI: CHEBI:28875 IUPAC Name: tetradecanoic acid SMILES: CCCCCCCCCCCCCC(O)=O

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Specifications

PubChem CID	11005
CAS	544-63-8
Molecular Weight (g/mol)	228.38
ChEBI	CHEBI:28875
MDL Number	MFCD00002744
SMILES	CCCCCCCCCCCCCC(O)=O
Synonym	myristic acid,n-tetradecanoic acid,n-tetradecoic acid,crodacid,n-tetradecan-1-oic acid,1-tridecanecarboxylic acid,hydrofol acid 1495,univol u 316s,emery 655,myristinsaeure
IUPAC Name	tetradecanoic acid
InChI Key	TUNFSRHWOTWDNC-UHFFFAOYSA-N
Molecular Formula	C14H28O2

Heptadecanoic acid, 98%

CAS: 506-12-7 Molecular Formula: C₁₇H₃₄O₂ Molecular Weight (g/mol): 270.44 MDL Number: MFCD00002751 InChI Key: KEMQGTRYUADPNZ-UHFFFAOYSA-N Synonym: margaric acid,n-heptadecanoic acid,margarinic acid,n-heptadecylic acid,n-heptadecoic acid,heptadecylic acid,fatty acids, c16-18,unii-v987y9oz8l,normal-heptadecanoic acid,margarinate PubChem CID: 10465 ChEBI: CHEBI:32365 IUPAC Name: heptadecanoic acid SMILES: CCCCCCCCCCCCCCCCC(=O)O

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PubChem CID	10465
CAS	506-12-7
Molecular Weight (g/mol)	270.44
ChEBI	CHEBI:32365
MDL Number	MFCD00002751
SMILES	CCCCCCCCCCCCCCCCC(=O)O
Synonym	margaric acid,n-heptadecanoic acid,margarinic acid,n-heptadecylic acid,n-heptadecoic acid,heptadecylic acid,fatty acids, c16-18,unii-v987y9oz8l,normal-heptadecanoic acid,margarinate
IUPAC Name	heptadecanoic acid
InChI Key	KEMQGTRYUADPNZ-UHFFFAOYSA-N
Molecular Formula	C₁₇H₃₄O₂

Sodium fumarate, 98%

CAS: 17013-01-3 Molecular Formula: C₄H₂Na₂O₄ Molecular Weight (g/mol): 160.04 MDL Number: MFCD00064567 InChI Key: VXXVUHAXJHEYFH-SEPHDYHBSA-N Synonym: disodium fumarate,sodium fumarate,sodium fumarate dibasic,fumaric acid, disodium salt,fumaric acid disodium salt,fumaran sodny czech,fumaran sodny,disodium butenedioate,di-sodium fumarate,sodium monofumarate PubChem CID: 87110070 IUPAC Name: (E)-but-2-enedioic acid;sodium SMILES: C(=CC(=O)O)C(=O)O.[Na].[Na]

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Specifications

PubChem CID	87110070
CAS	17013-01-3
Molecular Weight (g/mol)	160.04
MDL Number	MFCD00064567
SMILES	C(=CC(=O)O)C(=O)O.[Na].[Na]
Synonym	disodium fumarate,sodium fumarate,sodium fumarate dibasic,fumaric acid, disodium salt,fumaric acid disodium salt,fumaran sodny czech,fumaran sodny,disodium butenedioate,di-sodium fumarate,sodium monofumarate
IUPAC Name	(E)-but-2-enedioic acid;sodium
InChI Key	VXXVUHAXJHEYFH-SEPHDYHBSA-N
Molecular Formula	C₄H₂Na₂O₄

2-Bromobutyric acid, 98%

CAS: 80-58-0 Molecular Formula: C4H7BrO2 Molecular Weight (g/mol): 167.00 MDL Number: MFCD00004216,MFCD00210111,MFCD00210112 InChI Key: YAQLSKVCTLCIIE-UHFFFAOYNA-N Synonym: 2-bromobutyric acid,alpha-bromobutyric acid,butanoic acid, 2-bromo,butyric acid, 2-bromo,.alpha.-bromobytyric acid,butyric acid, .alpha.-bromo,dl-2-bromobutyric acid,a-bromobutyric acid,butyric acid, alpha-bromo,bromobutyric acid PubChem CID: 6655 IUPAC Name: 2-bromobutanoic acid SMILES: CCC(Br)C(O)=O

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Specifications

PubChem CID	6655
CAS	80-58-0
Molecular Weight (g/mol)	167.00
MDL Number	MFCD00004216,MFCD00210111,MFCD00210112
SMILES	CCC(Br)C(O)=O
Synonym	2-bromobutyric acid,alpha-bromobutyric acid,butanoic acid, 2-bromo,butyric acid, 2-bromo,.alpha.-bromobytyric acid,butyric acid, .alpha.-bromo,dl-2-bromobutyric acid,a-bromobutyric acid,butyric acid, alpha-bromo,bromobutyric acid
IUPAC Name	2-bromobutanoic acid
InChI Key	YAQLSKVCTLCIIE-UHFFFAOYNA-N
Molecular Formula	C4H7BrO2

Fatty acid conjugates

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