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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Selectophore™ Oleic acid, ≥99.0%, MilliporeSigma™ Supelco™

MDL Number: MFCD00064242 Synonym: cis-9-Octadecenoic acid; Elainic acid

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MDL Number	MFCD00064242
Synonym	cis-9-Octadecenoic acid; Elainic acid

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8-Aminooctanoic acid, 99%

CAS: 1002-57-9 Molecular Formula: C8H17NO2 Molecular Weight (g/mol): 159.23 MDL Number: MFCD00008245 InChI Key: UQXNEWQGGVUVQA-UHFFFAOYSA-N Synonym: 8-aminocaprylic acid,octanoic acid, 8-amino,omega-aminocaprylic acid,8-amino caprylic acid,8-amino-octanoic acid,.omega.-aminocaprylic acid,8-amino capylic acid,8ac,8-aminocapylic acid,pubchem13165 PubChem CID: 66085 IUPAC Name: 8-aminooctanoic acid SMILES: NCCCCCCCC(O)=O

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PubChem CID	66085
CAS	1002-57-9
Molecular Weight (g/mol)	159.23
MDL Number	MFCD00008245
SMILES	NCCCCCCCC(O)=O
Synonym	8-aminocaprylic acid,octanoic acid, 8-amino,omega-aminocaprylic acid,8-amino caprylic acid,8-amino-octanoic acid,.omega.-aminocaprylic acid,8-amino capylic acid,8ac,8-aminocapylic acid,pubchem13165
IUPAC Name	8-aminooctanoic acid
InChI Key	UQXNEWQGGVUVQA-UHFFFAOYSA-N
Molecular Formula	C8H17NO2

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6-Heptenoic acid, 96%

CAS: 1119-60-4 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.171 MDL Number: MFCD00014382 InChI Key: RWNJOXUVHRXHSD-UHFFFAOYSA-N Synonym: 6-heptenoic acid,epsilon-heptenoic acid,rarechem al bo 1361,6-heptenoic acids,hept-6-enoic acids,acmc-20alyp,epsilon-heptenoic acids,6-heptenoic acid 1g PubChem CID: 70705 ChEBI: CHEBI:38363 IUPAC Name: hept-6-enoic acid SMILES: C=CCCCCC(=O)O

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PubChem CID	70705
CAS	1119-60-4
Molecular Weight (g/mol)	128.171
ChEBI	CHEBI:38363
MDL Number	MFCD00014382
SMILES	C=CCCCCC(=O)O
Synonym	6-heptenoic acid,epsilon-heptenoic acid,rarechem al bo 1361,6-heptenoic acids,hept-6-enoic acids,acmc-20alyp,epsilon-heptenoic acids,6-heptenoic acid 1g
IUPAC Name	hept-6-enoic acid
InChI Key	RWNJOXUVHRXHSD-UHFFFAOYSA-N
Molecular Formula	C7H12O2

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Thermo Scientific Chemicals all-trans-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 IUPAC Name: (2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid 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
IUPAC Name	(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoic acid
InChI Key	SHGAZHPCJJPHSC-YCNIQYBTSA-N
Molecular Formula	C20H28O2

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Octanoic acid, 99%

CAS: 124-07-2 Molecular Formula: C₈H₁₆O₂ Molecular Weight (g/mol): 144.21 MDL Number: MFCD00004429 InChI Key: WWZKQHOCKIZLMA-UHFFFAOYSA-N Synonym: caprylic acid,n-octanoic acid,octylic acid,n-caprylic acid,octoic acid,n-octylic acid,n-octoic acid,neo-fat 8,1-heptanecarboxylic acid,enantic acid PubChem CID: 379 ChEBI: CHEBI:28837 IUPAC Name: octanoic acid SMILES: CCCCCCCC(=O)O

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PubChem CID	379
CAS	124-07-2
Molecular Weight (g/mol)	144.21
ChEBI	CHEBI:28837
MDL Number	MFCD00004429
SMILES	CCCCCCCC(=O)O
Synonym	caprylic acid,n-octanoic acid,octylic acid,n-caprylic acid,octoic acid,n-octylic acid,n-octoic acid,neo-fat 8,1-heptanecarboxylic acid,enantic acid
IUPAC Name	octanoic acid
InChI Key	WWZKQHOCKIZLMA-UHFFFAOYSA-N
Molecular Formula	C₈H₁₆O₂

Sorbic Acid 99.0+%, TCI America™

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

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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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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

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2-Methylheptanoic acid, 98%

CAS: 1188-02-9 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.214 MDL Number: MFCD00142944 InChI Key: NKBWMBRPILTCRD-UHFFFAOYSA-N Synonym: 2-methylenanthic acid,heptanoic acid, 2-methyl,methylamylacetic acid,2-methyl-heptanoic acid,heptanoic acid, methyl,alpha-methylheptanoic acid,2-methyl heptanoic acid,heptane-2-carboxylic acid,fema no. 2706,heptanoic acid, 2-methyl-, 2s PubChem CID: 14475 IUPAC Name: 2-methylheptanoic acid SMILES: CCCCCC(C)C(=O)O

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PubChem CID	14475
CAS	1188-02-9
Molecular Weight (g/mol)	144.214
MDL Number	MFCD00142944
SMILES	CCCCCC(C)C(=O)O
Synonym	2-methylenanthic acid,heptanoic acid, 2-methyl,methylamylacetic acid,2-methyl-heptanoic acid,heptanoic acid, methyl,alpha-methylheptanoic acid,2-methyl heptanoic acid,heptane-2-carboxylic acid,fema no. 2706,heptanoic acid, 2-methyl-, 2s
IUPAC Name	2-methylheptanoic acid
InChI Key	NKBWMBRPILTCRD-UHFFFAOYSA-N
Molecular Formula	C8H16O2

MilliporeSigma™ InSolution™ Sinefungin, Calbiochem™,

CAS: 58944-73-3 Molecular Formula: C15H23N7O5 Molecular Weight (g/mol): 381.393 InChI Key: LMXOHSDXUQEUSF-LWCRYBRRSA-N Synonym: insolution sinefungin,2,5-diamino-6-2r,3s,4r,5r-5-6-aminopurin-9-yl-3,4-dihydroxyoxolan-2-yl hexanoic acid,antibiotic 32232rp,compound-57926 PubChem CID: 6917665 IUPAC Name: 2,5-diamino-6-[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]hexanoic acid SMILES: C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CC(CCC(C(=O)O)N)N)O)O

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Specifications

PubChem CID	6917665
CAS	58944-73-3
Molecular Weight (g/mol)	381.393
SMILES	C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CC(CCC(C(=O)O)N)N)O)O
Synonym	insolution sinefungin,2,5-diamino-6-2r,3s,4r,5r-5-6-aminopurin-9-yl-3,4-dihydroxyoxolan-2-yl hexanoic acid,antibiotic 32232rp,compound-57926
IUPAC Name	2,5-diamino-6-[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]hexanoic acid
InChI Key	LMXOHSDXUQEUSF-LWCRYBRRSA-N
Molecular Formula	C15H23N7O5

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Thermo Scientific Chemicals Eicosanoic acid, 98%

CAS: 506-30-9 Molecular Formula: C20H40O2 Molecular Weight (g/mol): 312.54 MDL Number: MFCD00002755 InChI Key: VKOBVWXKNCXXDE-UHFFFAOYSA-N Synonym: arachidic acid,eicosanoic acid,arachic acid,n-eicosanoic acid,arachidinic acid,arachidate,eicosanoate,unii-pqb8mjd4rb,pqb8mjd4rb,n-eicosanoate PubChem CID: 10467 ChEBI: CHEBI:28822 IUPAC Name: icosanoic acid SMILES: CCCCCCCCCCCCCCCCCCCC(O)=O

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PubChem CID	10467
CAS	506-30-9
Molecular Weight (g/mol)	312.54
ChEBI	CHEBI:28822
MDL Number	MFCD00002755
SMILES	CCCCCCCCCCCCCCCCCCCC(O)=O
Synonym	arachidic acid,eicosanoic acid,arachic acid,n-eicosanoic acid,arachidinic acid,arachidate,eicosanoate,unii-pqb8mjd4rb,pqb8mjd4rb,n-eicosanoate
IUPAC Name	icosanoic acid
InChI Key	VKOBVWXKNCXXDE-UHFFFAOYSA-N
Molecular Formula	C20H40O2

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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

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2-Hexynoic acid, 96%

CAS: 764-33-0 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.128 MDL Number: MFCD00014371 InChI Key: AKYAUBWOTZJUBI-UHFFFAOYSA-N Synonym: 2-hexynoic acid,hexynoic acid,acmc-1bezk,akyaubwotzjubi-uhfffaoysa PubChem CID: 324380 IUPAC Name: hex-2-ynoic acid SMILES: CCCC#CC(=O)O

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PubChem CID	324380
CAS	764-33-0
Molecular Weight (g/mol)	112.128
MDL Number	MFCD00014371
SMILES	CCCC#CC(=O)O
Synonym	2-hexynoic acid,hexynoic acid,acmc-1bezk,akyaubwotzjubi-uhfffaoysa
IUPAC Name	hex-2-ynoic acid
InChI Key	AKYAUBWOTZJUBI-UHFFFAOYSA-N
Molecular Formula	C6H8O2

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Magnesium stearate, 3.8-5.0% Mg

CAS: 557-04-0 Molecular Formula: C₃₆H₇₀MgO₄ Molecular Weight (g/mol): 591.27 InChI Key: HQKMJHAJHXVSDF-UHFFFAOYSA-L Synonym: magnesium stearate,magnesium octadecanoate,magnesium distearate,synpro 90,octadecanoic acid, magnesium salt,dibasic magnesium stearate,petrac mg 20nf,ns-m salt,sm-p,stearic acid, magnesium salt PubChem CID: 11177 ChEBI: CHEBI:9254 IUPAC Name: magnesium;octadecanoate SMILES: CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Mg+2]

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PubChem CID	11177
CAS	557-04-0
Molecular Weight (g/mol)	591.27
ChEBI	CHEBI:9254
SMILES	CCCCCCCCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCCCCCCCC(=O)[O-].[Mg+2]
Synonym	magnesium stearate,magnesium octadecanoate,magnesium distearate,synpro 90,octadecanoic acid, magnesium salt,dibasic magnesium stearate,petrac mg 20nf,ns-m salt,sm-p,stearic acid, magnesium salt
IUPAC Name	magnesium;octadecanoate
InChI Key	HQKMJHAJHXVSDF-UHFFFAOYSA-L
Molecular Formula	C₃₆H₇₀MgO₄

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2-Octynoic acid, 98%

CAS: 5663-96-7 Molecular Formula: C8H12O2 Molecular Weight (g/mol): 140.182 MDL Number: MFCD00004364 InChI Key: BQDKCWCMDBMLEH-UHFFFAOYSA-N Synonym: 2-octynoic acid,2-octyn-1-oic acid,m-pentyl propiolate,propiolic acid, pentyl,propiolic acid, pentyl ester,pentylpropiolic acid,2-oa,2-octynoicacid,acmc-1apg2,epitope id:137475 PubChem CID: 21872 ChEBI: CHEBI:60295 IUPAC Name: oct-2-ynoic acid SMILES: CCCCCC#CC(=O)O

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PubChem CID	21872
CAS	5663-96-7
Molecular Weight (g/mol)	140.182
ChEBI	CHEBI:60295
MDL Number	MFCD00004364
SMILES	CCCCCC#CC(=O)O
Synonym	2-octynoic acid,2-octyn-1-oic acid,m-pentyl propiolate,propiolic acid, pentyl,propiolic acid, pentyl ester,pentylpropiolic acid,2-oa,2-octynoicacid,acmc-1apg2,epitope id:137475
IUPAC Name	oct-2-ynoic acid
InChI Key	BQDKCWCMDBMLEH-UHFFFAOYSA-N
Molecular Formula	C8H12O2

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Lithium stearate, 95%

CAS: 4485-12-5 Molecular Formula: C₁₈H₃₅LiO₂ Molecular Weight (g/mol): 290.41 MDL Number: MFCD00042032 InChI Key: HGPXWXLYXNVULB-UHFFFAOYSA-M Synonym: lithium stearate,lithium octadecanoate,octadecanoic acid, lithium salt,stearic acid, lithium salt,lithalure,litholite,stavinor,lithium stearate, pure,stearic acid lithium salt,unii-p31mc94p70 PubChem CID: 517357 IUPAC Name: lithium;octadecanoate SMILES: [Li+].CCCCCCCCCCCCCCCCCC(=O)[O-]

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PubChem CID	517357
CAS	4485-12-5
Molecular Weight (g/mol)	290.41
MDL Number	MFCD00042032
SMILES	[Li+].CCCCCCCCCCCCCCCCCC(=O)[O-]
Synonym	lithium stearate,lithium octadecanoate,octadecanoic acid, lithium salt,stearic acid, lithium salt,lithalure,litholite,stavinor,lithium stearate, pure,stearic acid lithium salt,unii-p31mc94p70
IUPAC Name	lithium;octadecanoate
InChI Key	HGPXWXLYXNVULB-UHFFFAOYSA-M
Molecular Formula	C₁₈H₃₅LiO₂

Fatty acid conjugates

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