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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2,401 – 2,415 of 2,421 results

2,401

4-(2-Chloroethylsulfonyl)butyric Acid 97.0+%, TCI America™

CAS: 121315-24-0 Molecular Formula: C6H11ClO4S Molecular Weight (g/mol): 214.66 InChI Key: XOPHFHGOBYWODX-UHFFFAOYSA-N PubChem CID: 18981220 IUPAC Name: 4-(2-chloroethylsulfonyl)butanoic acid SMILES: C(CC(=O)O)CS(=O)(=O)CCCl

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Specifications

PubChem CID	18981220
CAS	121315-24-0
Molecular Weight (g/mol)	214.66
SMILES	C(CC(=O)O)CS(=O)(=O)CCCl
IUPAC Name	4-(2-chloroethylsulfonyl)butanoic acid
InChI Key	XOPHFHGOBYWODX-UHFFFAOYSA-N
Molecular Formula	C6H11ClO4S

2,402

2,4-Pentadecadiynoic Acid, TCI America™

CAS: 174063-99-1 Molecular Formula: C15H22O2 Molecular Weight (g/mol): 234.339 MDL Number: MFCD00060115 InChI Key: XRCJABKXJJKZPH-UHFFFAOYSA-N PubChem CID: 24206711 IUPAC Name: pentadeca-2,4-diynoic acid SMILES: CCCCCCCCCCC#CC#CC(=O)O

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Specifications

PubChem CID	24206711
CAS	174063-99-1
Molecular Weight (g/mol)	234.339
MDL Number	MFCD00060115
SMILES	CCCCCCCCCCC#CC#CC(=O)O
IUPAC Name	pentadeca-2,4-diynoic acid
InChI Key	XRCJABKXJJKZPH-UHFFFAOYSA-N
Molecular Formula	C15H22O2

2,403

S-(N,N-Dimethylthiocarbamoyl)thioglycolic Acid 97.0+%, TCI America™

CAS: 4007-01-6 Molecular Formula: C5H9NO2S2 Molecular Weight (g/mol): 179.25 MDL Number: MFCD00021765 InChI Key: FYGUGMCPHDSCLF-UHFFFAOYSA-N Synonym: S-(N,N-Dimethylthiocarbamoyl)mercaptoacetic Acid PubChem CID: 301695 IUPAC Name: 2-(dimethylcarbamothioylsulfanyl)acetic acid SMILES: CN(C)C(=S)SCC(=O)O

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Specifications

PubChem CID	301695
CAS	4007-01-6
Molecular Weight (g/mol)	179.25
MDL Number	MFCD00021765
SMILES	CN(C)C(=S)SCC(=O)O
Synonym	S-(N,N-Dimethylthiocarbamoyl)mercaptoacetic Acid
IUPAC Name	2-(dimethylcarbamothioylsulfanyl)acetic acid
InChI Key	FYGUGMCPHDSCLF-UHFFFAOYSA-N
Molecular Formula	C5H9NO2S2

2,404

Emedastine Difumarate 98.0+%, TCI America™

CAS: 87233-62-3 Molecular Formula: C25H34N4O9 Molecular Weight (g/mol): 534.566 MDL Number: MFCD00923844 InChI Key: FWLKKPKZQYVAFR-LVEZLNDCSA-N Synonym: 1-(2-Ethoxyethyl)-2-(4-methyl-1-homopiperazinyl)benzimidazole Difumarate PubChem CID: 5282485 IUPAC Name: (E)-but-2-enedioic acid;1-(2-ethoxyethyl)-2-(4-methyl-1,4-diazepan-1-yl)benzimidazole SMILES: CCOCCN1C2=CC=CC=C2N=C1N3CCCN(CC3)C.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O

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Specifications

PubChem CID	5282485
CAS	87233-62-3
Molecular Weight (g/mol)	534.566
MDL Number	MFCD00923844
SMILES	CCOCCN1C2=CC=CC=C2N=C1N3CCCN(CC3)C.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O
Synonym	1-(2-Ethoxyethyl)-2-(4-methyl-1-homopiperazinyl)benzimidazole Difumarate
IUPAC Name	(E)-but-2-enedioic acid;1-(2-ethoxyethyl)-2-(4-methyl-1,4-diazepan-1-yl)benzimidazole
InChI Key	FWLKKPKZQYVAFR-LVEZLNDCSA-N
Molecular Formula	C25H34N4O9

2,405

2,2,6,6-Tetramethylpimelic Acid 98.0+%, TCI America™

CAS: 2941-45-9 Molecular Formula: C11H18O4 Molecular Weight (g/mol): 214.26 MDL Number: MFCD00800574 InChI Key: CKUJONFLPBQEKM-UHFFFAOYSA-L Synonym: 2,2,6,6-tetramethylpimelic acid,acmc-209h8n,heptanedioic acid,2,2,6,6-tetramethyl PubChem CID: 2733156 IUPAC Name: 2,2,6,6-tetramethylheptanedioate SMILES: CC(C)(CCCC(C)(C)C([O-])=O)C([O-])=O

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Specifications

PubChem CID	2733156
CAS	2941-45-9
Molecular Weight (g/mol)	214.26
MDL Number	MFCD00800574
SMILES	CC(C)(CCCC(C)(C)C([O-])=O)C([O-])=O
Synonym	2,2,6,6-tetramethylpimelic acid,acmc-209h8n,heptanedioic acid,2,2,6,6-tetramethyl
IUPAC Name	2,2,6,6-tetramethylheptanedioate
InChI Key	CKUJONFLPBQEKM-UHFFFAOYSA-L
Molecular Formula	C11H18O4

2,406

Sodium Hexanoate 99.0+%, TCI America™

CAS: 10051-44-2 Molecular Formula: C6H11NaO2 Molecular Weight (g/mol): 138.14 MDL Number: MFCD00059056 InChI Key: UDWXLZLRRVQONG-UHFFFAOYSA-M Synonym: sodium hexanoate,sodium caproate,hexanoic acid, sodium salt,hexanoic acid sodium salt,sodium capronate,sodium n-caproate,sodium n-hexanoate,unii-e00cg11s66,caproic acid sodium salt,hexanoic acid, sodium salt 1:1 PubChem CID: 4087444 IUPAC Name: sodium hexanoate SMILES: [Na+].CCCCCC([O-])=O

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PubChem CID	4087444
CAS	10051-44-2
Molecular Weight (g/mol)	138.14
MDL Number	MFCD00059056
SMILES	[Na+].CCCCCC([O-])=O
Synonym	sodium hexanoate,sodium caproate,hexanoic acid, sodium salt,hexanoic acid sodium salt,sodium capronate,sodium n-caproate,sodium n-hexanoate,unii-e00cg11s66,caproic acid sodium salt,hexanoic acid, sodium salt 1:1
IUPAC Name	sodium hexanoate
InChI Key	UDWXLZLRRVQONG-UHFFFAOYSA-M
Molecular Formula	C6H11NaO2

2,407

10,12-Tricosadiynoic Acid 98.0+%, TCI America™

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2,408

16-DOXYL-stearic Acid Free Radical 97.0+%, TCI America™

CAS: 53034-38-1 Molecular Formula: C22H42NO4 Molecular Weight (g/mol): 384.58 MDL Number: MFCD00010066 InChI Key: BPDFMDXURXAITH-JOCHJYFZSA-M Synonym: 16-doxyl-stearic acid,16-nitroxystearate,16-doxylstearic acid,16-doxyl-stearic acid, free radical,16-doxylstearate,16-doxyl-ste,16-doxystearic acid,fasl 1,14,16doxyl,15-2-ethyl-3 PubChem CID: 2724321 IUPAC Name: 15-[(2R)-2-ethyl-3-hydroxy-4,4-dimethyl-1,3-oxazolidin-2-yl]pentadecanoate SMILES: CC[C@]1(CCCCCCCCCCCCCCC([O-])=O)OCC(C)(C)N1O

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Specifications

PubChem CID	2724321
CAS	53034-38-1
Molecular Weight (g/mol)	384.58
MDL Number	MFCD00010066
SMILES	CC[C@]1(CCCCCCCCCCCCCCC([O-])=O)OCC(C)(C)N1O
Synonym	16-doxyl-stearic acid,16-nitroxystearate,16-doxylstearic acid,16-doxyl-stearic acid, free radical,16-doxylstearate,16-doxyl-ste,16-doxystearic acid,fasl 1,14,16doxyl,15-2-ethyl-3
IUPAC Name	15-[(2R)-2-ethyl-3-hydroxy-4,4-dimethyl-1,3-oxazolidin-2-yl]pentadecanoate
InChI Key	BPDFMDXURXAITH-JOCHJYFZSA-M
Molecular Formula	C22H42NO4

2,409

2-Methyl-2-hexenoic Acid, TCI America™

CAS: 28897-58-7 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.171 MDL Number: MFCD00015855 InChI Key: AKOVMBAFZSPEQU-AATRIKPKSA-N Synonym: 2-methyl-2-hexenoic acid,2-hexenoic acid, 2-methyl,e-2-methylhex-2-enoic acid,2-methylhex-2-enoic acid,e-2-methyl-2-hexenoic acid,2e-2-methylhex-2-enoic acid,2-methyl-2e-hexenoic acid,2e-2-methyl-2-hexenoic acid # PubChem CID: 5282650 IUPAC Name: (E)-2-methylhex-2-enoic acid SMILES: CCCC=C(C)C(=O)O

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Specifications

PubChem CID	5282650
CAS	28897-58-7
Molecular Weight (g/mol)	128.171
MDL Number	MFCD00015855
SMILES	CCCC=C(C)C(=O)O
Synonym	2-methyl-2-hexenoic acid,2-hexenoic acid, 2-methyl,e-2-methylhex-2-enoic acid,2-methylhex-2-enoic acid,e-2-methyl-2-hexenoic acid,2e-2-methylhex-2-enoic acid,2-methyl-2e-hexenoic acid,2e-2-methyl-2-hexenoic acid #
IUPAC Name	(E)-2-methylhex-2-enoic acid
InChI Key	AKOVMBAFZSPEQU-AATRIKPKSA-N
Molecular Formula	C7H12O2

2,410

Mepyramine maleate, Tocris Bioscience™

CAS: 59-33-6 Molecular Formula: C21H27N3O5 Molecular Weight (g/mol): 401.46 MDL Number: MFCD00069333 InChI Key: JXYWFNAQESKDNC-BTJKTKAUSA-N Synonym: pyrilamine maleate,mepyramine maleate,anisopyradamine,histosol,minihist,diaminide maleate,paraminyl maleate,antihist,histatex,histine PubChem CID: 5284451 IUPAC Name: (2Z)-but-2-enedioic acid; N-[2-(dimethylamino)ethyl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine SMILES: OC(=O)\C=C/C(O)=O.COC1=CC=C(CN(CCN(C)C)C2=CC=CC=N2)C=C1

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Specifications

PubChem CID	5284451
CAS	59-33-6
Molecular Weight (g/mol)	401.46
MDL Number	MFCD00069333
SMILES	OC(=O)\C=C/C(O)=O.COC1=CC=C(CN(CCN(C)C)C2=CC=CC=N2)C=C1
Synonym	pyrilamine maleate,mepyramine maleate,anisopyradamine,histosol,minihist,diaminide maleate,paraminyl maleate,antihist,histatex,histine
IUPAC Name	(2Z)-but-2-enedioic acid; N-[2-(dimethylamino)ethyl]-N-[(4-methoxyphenyl)methyl]pyridin-2-amine
InChI Key	JXYWFNAQESKDNC-BTJKTKAUSA-N
Molecular Formula	C21H27N3O5

2,411

ICI 192,605, Tocris Bioscience™

CAS: 117621-64-4 Molecular Formula: C22H23ClO5 Molecular Weight (g/mol): 402.87 MDL Number: MFCD00673936 InChI Key: WHUIENZXNGAHQI-YGPRPMEGSA-N Synonym: d0b9na,6-2beta-2-chlorophenyl-6beta-2-hydroxyphenyl-1,3-dioxan-5beta-yl-4-hexenoic acid,e-6-2s,4s,5r-2-2-chlorophenyl-4-2-hydroxyphenyl-1,3-dioxan-5-yl hex-4-enoic acid PubChem CID: 23654676 IUPAC Name: (4Z)-6-[(2R,4R,5S)-2-(2-chlorophenyl)-4-(2-hydroxyphenyl)-1,3-dioxan-5-yl]hex-4-enoic acid SMILES: OC(=O)CC\C=C/C[C@H]1CO[C@H](O[C@H]1C1=CC=CC=C1O)C1=CC=CC=C1Cl

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Specifications

PubChem CID	23654676
CAS	117621-64-4
Molecular Weight (g/mol)	402.87
MDL Number	MFCD00673936
SMILES	OC(=O)CC\C=C/C[C@H]1CO[C@H](O[C@H]1C1=CC=CC=C1O)C1=CC=CC=C1Cl
Synonym	d0b9na,6-2beta-2-chlorophenyl-6beta-2-hydroxyphenyl-1,3-dioxan-5beta-yl-4-hexenoic acid,e-6-2s,4s,5r-2-2-chlorophenyl-4-2-hydroxyphenyl-1,3-dioxan-5-yl hex-4-enoic acid
IUPAC Name	(4Z)-6-[(2R,4R,5S)-2-(2-chlorophenyl)-4-(2-hydroxyphenyl)-1,3-dioxan-5-yl]hex-4-enoic acid
InChI Key	WHUIENZXNGAHQI-YGPRPMEGSA-N
Molecular Formula	C22H23ClO5

2,412

CGS 9343B, Tocris Bioscience™

CAS: 109826-27-9 Molecular Formula: C30H32N4O6 Molecular Weight (g/mol): 544.61 MDL Number: MFCD04113002 InChI Key: NGODOSILXOFQPH-BTJKTKAUNA-N Synonym: 1,3-dihydro-1-1-4-methyl-4h,6h-pyrrolo 1,2-a 4,1-benzoxazepin-4-yl methyl-4-piperidinyl-2h-benzimidazol-2-one maleate PubChem CID: 14171586 IUPAC Name: (2Z)-but-2-enedioic acid; 1-[1-({7-methyl-8-oxa-2-azatricyclo[8.4.0.0²,⁶]tetradeca-1(14),3,5,10,12-pentaen-7-yl}methyl)piperidin-4-yl]-2,3-dihydro-1H-1,3-benzodiazol-2-one SMILES: OC(=O)\C=C/C(O)=O.CC1(CN2CCC(CC2)N2C(=O)NC3=CC=CC=C23)OCC2=CC=CC=C2N2C=CC=C12

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Specifications

PubChem CID	14171586
CAS	109826-27-9
Molecular Weight (g/mol)	544.61
MDL Number	MFCD04113002
SMILES	OC(=O)\C=C/C(O)=O.CC1(CN2CCC(CC2)N2C(=O)NC3=CC=CC=C23)OCC2=CC=CC=C2N2C=CC=C12
Synonym	1,3-dihydro-1-1-4-methyl-4h,6h-pyrrolo 1,2-a 4,1-benzoxazepin-4-yl methyl-4-piperidinyl-2h-benzimidazol-2-one maleate
IUPAC Name	(2Z)-but-2-enedioic acid; 1-[1-({7-methyl-8-oxa-2-azatricyclo[8.4.0.0²,⁶]tetradeca-1(14),3,5,10,12-pentaen-7-yl}methyl)piperidin-4-yl]-2,3-dihydro-1H-1,3-benzodiazol-2-one
InChI Key	NGODOSILXOFQPH-BTJKTKAUNA-N
Molecular Formula	C30H32N4O6

2,413

17-ODYA, Tocris Bioscience™

CAS: 34450-18-5 Molecular Formula: C18H32O2 Molecular Weight (g/mol): 280.452 InChI Key: DZIILFGADWDKMF-UHFFFAOYSA-N Synonym: 17-octadecynoic acid,17-odya,alkynyl stearic acid,tocris-0607,bml3-c04,17-odya 17-octadecynoic acid,17-octadecynoic acid gc PubChem CID: 1449 IUPAC Name: octadec-17-ynoic acid SMILES: C#CCCCCCCCCCCCCCCCC(=O)O

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Specifications

PubChem CID	1449
CAS	34450-18-5
Molecular Weight (g/mol)	280.452
SMILES	C#CCCCCCCCCCCCCCCCC(=O)O
Synonym	17-octadecynoic acid,17-odya,alkynyl stearic acid,tocris-0607,bml3-c04,17-odya 17-octadecynoic acid,17-octadecynoic acid gc
IUPAC Name	octadec-17-ynoic acid
InChI Key	DZIILFGADWDKMF-UHFFFAOYSA-N
Molecular Formula	C18H32O2

2,414

Arachidonic acid (inTocris Bioscience™olve100), Tocris Bioscience™

CAS: 506-32-1 Molecular Formula: C20H32O2 Molecular Weight (g/mol): 304.474 InChI Key: YZXBAPSDXZZRGB-DOFZRALJSA-N Synonym: arachidonic acid,arachidonate,immunocytophyte,all-z-5,8,11,14-eicosatetraenoic acid,5z,8z,11z,14z-icosa-5,8,11,14-tetraenoic acid,cis-5,8,11,14-eicosatetraenoic acid,5,8,11,14-eicosatetraenoic acid, all-z,all-cis-5,8,11,14-eicosatetraenoic acid,unii-27yg812j1i,5z,8z,11z,14z-eicosatetraenoic acid PubChem CID: 444899 ChEBI: CHEBI:15843 IUPAC Name: (5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid SMILES: CCCCCC=CCC=CCC=CCC=CCCCC(=O)O

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Specifications

PubChem CID	444899
CAS	506-32-1
Molecular Weight (g/mol)	304.474
ChEBI	CHEBI:15843
SMILES	CCCCCC=CCC=CCC=CCC=CCCCC(=O)O
Synonym	arachidonic acid,arachidonate,immunocytophyte,all-z-5,8,11,14-eicosatetraenoic acid,5z,8z,11z,14z-icosa-5,8,11,14-tetraenoic acid,cis-5,8,11,14-eicosatetraenoic acid,5,8,11,14-eicosatetraenoic acid, all-z,all-cis-5,8,11,14-eicosatetraenoic acid,unii-27yg812j1i,5z,8z,11z,14z-eicosatetraenoic acid
IUPAC Name	(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoic acid
InChI Key	YZXBAPSDXZZRGB-DOFZRALJSA-N
Molecular Formula	C20H32O2

2,415

ICI 185,282, Tocris Bioscience™

CAS: 106393-80-0 Molecular Formula: C18H21F3O5 Molecular Weight (g/mol): 374.356 InChI Key: ZWAVGFSZMACJHA-PMNBYGLBSA-N Synonym: 5-z-7-4-o-hydroxyphenyl-2-trifluoromethyl-1,3 dioxan-cis-5-yl heptenoic acid,tocris-0836,7-4-o-hydroxyphenyl-2-trifluoromethyl-1,3-dioxan-5-yl heptenoic acid,z-7-2s,4s,5r-4-2-hydroxyphenyl-2-trifluoromethyl-1,3-dioxan-5-yl hept-5-enoic acid,z-7-4alpha-2-hydroxyphenyl-2alpha-trifluoromethyl-1,3-dioxan-5alpha-yl-5-heptenoic acid,5-heptenoic acid, 7-4-2-hydroxyphenyl-2-trifluoromethyl-1,3-dioxan-5-yl-, 2alpha,4alpha,5alpha z PubChem CID: 5311390 IUPAC Name: (Z)-7-[(2S,4S,5R)-4-(2-hydroxyphenyl)-2-(trifluoromethyl)-1,3-dioxan-5-yl]hept-5-enoic acid SMILES: C1C(C(OC(O1)C(F)(F)F)C2=CC=CC=C2O)CC=CCCCC(=O)O

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Specifications

PubChem CID	5311390
CAS	106393-80-0
Molecular Weight (g/mol)	374.356
SMILES	C1C(C(OC(O1)C(F)(F)F)C2=CC=CC=C2O)CC=CCCCC(=O)O
Synonym	5-z-7-4-o-hydroxyphenyl-2-trifluoromethyl-1,3 dioxan-cis-5-yl heptenoic acid,tocris-0836,7-4-o-hydroxyphenyl-2-trifluoromethyl-1,3-dioxan-5-yl heptenoic acid,z-7-2s,4s,5r-4-2-hydroxyphenyl-2-trifluoromethyl-1,3-dioxan-5-yl hept-5-enoic acid,z-7-4alpha-2-hydroxyphenyl-2alpha-trifluoromethyl-1,3-dioxan-5alpha-yl-5-heptenoic acid,5-heptenoic acid, 7-4-2-hydroxyphenyl-2-trifluoromethyl-1,3-dioxan-5-yl-, 2alpha,4alpha,5alpha z
IUPAC Name	(Z)-7-[(2S,4S,5R)-4-(2-hydroxyphenyl)-2-(trifluoromethyl)-1,3-dioxan-5-yl]hept-5-enoic acid
InChI Key	ZWAVGFSZMACJHA-PMNBYGLBSA-N
Molecular Formula	C18H21F3O5

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