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 – 15 of 568 results

5,8,11,14-Eicosatetraynoic acid

CAS: 1191-85-1 Molecular Formula: C20H24O2 Molecular Weight (g/mol): 296.41 MDL Number: MFCD00036967 InChI Key: MGLDCXPLYOWQRP-UHFFFAOYSA-N Synonym: etya,5,8,11,14-eicosatetraynoic acid,octadehydroarachidonic acid,eicosatetranoic acid,opera_id_402,spectrum5_001952,d0g9ip,bml2-f04,5,8,11,14-eicosatetraynoicacid,5,8,11,14-icosatetraynoic acid # PubChem CID: 1780 IUPAC Name: icosa-5,8,11,14-tetraynoic acid SMILES: CCCCCC#CCC#CCC#CCC#CCCCC(=O)O

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PubChem CID	1780
CAS	1191-85-1
Molecular Weight (g/mol)	296.41
MDL Number	MFCD00036967
SMILES	CCCCCC#CCC#CCC#CCC#CCCCC(=O)O
Synonym	etya,5,8,11,14-eicosatetraynoic acid,octadehydroarachidonic acid,eicosatetranoic acid,opera_id_402,spectrum5_001952,d0g9ip,bml2-f04,5,8,11,14-eicosatetraynoicacid,5,8,11,14-icosatetraynoic acid #
IUPAC Name	icosa-5,8,11,14-tetraynoic acid
InChI Key	MGLDCXPLYOWQRP-UHFFFAOYSA-N
Molecular Formula	C20H24O2

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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Specifications

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

Ethyl hydrogen sebacate, 98%

CAS: 693-55-0 Molecular Formula: C12H22O4 Molecular Weight (g/mol): 230.304 MDL Number: MFCD00014387 InChI Key: DLZCDMPHHUODDO-UHFFFAOYSA-N Synonym: ethyl hydrogen sebacate,monoethyl sebacate,sebacic acid, monoethyl ester,decanedioic acid monoethyl ester,decanedioic acid, 1-ethyl ester,decanedioic acid, monoethyl ester,sebacinsaureathylester,mono-ethyl sebacate,sebacic acid 1-ethyl ester,decanedioic acid 1-ethyl ester PubChem CID: 69660 IUPAC Name: 10-ethoxy-10-oxodecanoic acid SMILES: CCOC(=O)CCCCCCCCC(=O)O

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Specifications

PubChem CID	69660
CAS	693-55-0
Molecular Weight (g/mol)	230.304
MDL Number	MFCD00014387
SMILES	CCOC(=O)CCCCCCCCC(=O)O
Synonym	ethyl hydrogen sebacate,monoethyl sebacate,sebacic acid, monoethyl ester,decanedioic acid monoethyl ester,decanedioic acid, 1-ethyl ester,decanedioic acid, monoethyl ester,sebacinsaureathylester,mono-ethyl sebacate,sebacic acid 1-ethyl ester,decanedioic acid 1-ethyl ester
IUPAC Name	10-ethoxy-10-oxodecanoic acid
InChI Key	DLZCDMPHHUODDO-UHFFFAOYSA-N
Molecular Formula	C12H22O4

Stearic acid, 90+%

CAS: 57-11-4 Molecular Formula: C18H36O2 Molecular Weight (g/mol): 284.48 MDL Number: MFCD00002752 InChI Key: QIQXTHQIDYTFRH-UHFFFAOYSA-N Synonym: stearic acid,stearophanic acid,n-octadecanoic acid,cetylacetic acid,pearl stearic,stearex beads,octadecansaeure,stearinsaeure,vanicol,1-heptadecanecarboxylic acid PubChem CID: 5281 ChEBI: CHEBI:28842 IUPAC Name: octadecanoic acid SMILES: CCCCCCCCCCCCCCCCCC(O)=O

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Specifications

PubChem CID	5281
CAS	57-11-4
Molecular Weight (g/mol)	284.48
ChEBI	CHEBI:28842
MDL Number	MFCD00002752
SMILES	CCCCCCCCCCCCCCCCCC(O)=O
Synonym	stearic acid,stearophanic acid,n-octadecanoic acid,cetylacetic acid,pearl stearic,stearex beads,octadecansaeure,stearinsaeure,vanicol,1-heptadecanecarboxylic acid
IUPAC Name	octadecanoic acid
InChI Key	QIQXTHQIDYTFRH-UHFFFAOYSA-N
Molecular Formula	C18H36O2

5-Bromovaleric acid, 97%

CAS: 2067-33-6 Molecular Formula: C₅H₉BrO₂ Molecular Weight (g/mol): 181.03 MDL Number: MFCD00004414 InChI Key: WNXNUPJZWYOKMW-UHFFFAOYSA-N Synonym: 5-bromovaleric acid,pentanoic acid, 5-bromo,5-bromo-n-valeric acid,valeric acid, 5-bromo,5-bromovalenc acid,1-bromo-4-carboxybutane,.delta.-bromovaleric acid,delta-bromovaleric acid,5-bromo valeric acid,5-bromoval eric acid PubChem CID: 16368 IUPAC Name: 5-bromopentanoic acid SMILES: C(CCBr)CC(=O)O

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Specifications

PubChem CID	16368
CAS	2067-33-6
Molecular Weight (g/mol)	181.03
MDL Number	MFCD00004414
SMILES	C(CCBr)CC(=O)O
Synonym	5-bromovaleric acid,pentanoic acid, 5-bromo,5-bromo-n-valeric acid,valeric acid, 5-bromo,5-bromovalenc acid,1-bromo-4-carboxybutane,.delta.-bromovaleric acid,delta-bromovaleric acid,5-bromo valeric acid,5-bromoval eric acid
IUPAC Name	5-bromopentanoic acid
InChI Key	WNXNUPJZWYOKMW-UHFFFAOYSA-N
Molecular Formula	C₅H₉BrO₂

Pimelic Acid, 98%

CAS: 111-16-0 Molecular Formula: C7H12O4 Molecular Weight (g/mol): 160.17 MDL Number: MFCD00004425 InChI Key: WLJVNTCWHIRURA-UHFFFAOYSA-N Synonym: pimelic acid,1,5-pentanedicarboxylic acid,pileric acid,heptandioic acid,heptane-1,7-dioic acid,pimelate,6-carboxyhexanoate,6-carboxyhexanoic acid,1,7-heptanedioic acid,unii-bzq96wx25f PubChem CID: 385 ChEBI: CHEBI:30531 IUPAC Name: heptanedioic acid SMILES: OC(=O)CCCCCC(O)=O

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Specifications

PubChem CID	385
CAS	111-16-0
Molecular Weight (g/mol)	160.17
ChEBI	CHEBI:30531
MDL Number	MFCD00004425
SMILES	OC(=O)CCCCCC(O)=O
Synonym	pimelic acid,1,5-pentanedicarboxylic acid,pileric acid,heptandioic acid,heptane-1,7-dioic acid,pimelate,6-carboxyhexanoate,6-carboxyhexanoic acid,1,7-heptanedioic acid,unii-bzq96wx25f
IUPAC Name	heptanedioic acid
InChI Key	WLJVNTCWHIRURA-UHFFFAOYSA-N
Molecular Formula	C7H12O4

Docosanoic acid, 85%, technical

CAS: 112-85-6 Molecular Formula: C₂₂H₄₄O₂ Molecular Weight (g/mol): 340.58 MDL Number: MFCD00002807 InChI Key: UKMSUNONTOPOIO-UHFFFAOYSA-N Synonym: behenic acid,1-docosanoic acid,n-docosanoic acid,hydrofol acid 560,docosoic acid,hydrofol 2022-55,glycon b-70,behensaeure,docosanoicacid,docosansaeure PubChem CID: 8215 ChEBI: CHEBI:28941 IUPAC Name: docosanoic acid SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)O

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Specifications

PubChem CID	8215
CAS	112-85-6
Molecular Weight (g/mol)	340.58
ChEBI	CHEBI:28941
MDL Number	MFCD00002807
SMILES	CCCCCCCCCCCCCCCCCCCCCC(=O)O
Synonym	behenic acid,1-docosanoic acid,n-docosanoic acid,hydrofol acid 560,docosoic acid,hydrofol 2022-55,glycon b-70,behensaeure,docosanoicacid,docosansaeure
IUPAC Name	docosanoic acid
InChI Key	UKMSUNONTOPOIO-UHFFFAOYSA-N
Molecular Formula	C₂₂H₄₄O₂

2-Bromohexanoic acid, 97%

CAS: 616-05-7 Molecular Formula: C6H11BrO2 Molecular Weight (g/mol): 195.056 MDL Number: MFCD00004218 InChI Key: HZTPKMIMXLTOSK-UHFFFAOYSA-N Synonym: 2-bromocaproic acid,dl-2-bromohexanoic acid,hexanoic acid, 2-bromo,alpha-bromohexanoic acid,alpha-bromo-n-caproic acid,.alpha.-bromo-n-caproic acid,2-bromo-hexanoic acid,.alpha.-bromocaproic acid,.alpha.-bromohexanoic acid,2-bromo-n-hexanoic acid PubChem CID: 12013 IUPAC Name: 2-bromohexanoic acid SMILES: CCCCC(C(=O)O)Br

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Specifications

PubChem CID	12013
CAS	616-05-7
Molecular Weight (g/mol)	195.056
MDL Number	MFCD00004218
SMILES	CCCCC(C(=O)O)Br
Synonym	2-bromocaproic acid,dl-2-bromohexanoic acid,hexanoic acid, 2-bromo,alpha-bromohexanoic acid,alpha-bromo-n-caproic acid,.alpha.-bromo-n-caproic acid,2-bromo-hexanoic acid,.alpha.-bromocaproic acid,.alpha.-bromohexanoic acid,2-bromo-n-hexanoic acid
IUPAC Name	2-bromohexanoic acid
InChI Key	HZTPKMIMXLTOSK-UHFFFAOYSA-N
Molecular Formula	C6H11BrO2

5-Hexynoic acid, 96%

CAS: 53293-00-8 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.128 MDL Number: MFCD00066346 InChI Key: VPFMEXRVUOPYRG-UHFFFAOYSA-N Synonym: 5-hexynoic acid,5-hexyn-1-oic acid,4-ethynylbutyric acid,acmc-1an4h PubChem CID: 143036 ChEBI: CHEBI:73511 IUPAC Name: hex-5-ynoic acid SMILES: C#CCCCC(=O)O

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Specifications

PubChem CID	143036
CAS	53293-00-8
Molecular Weight (g/mol)	112.128
ChEBI	CHEBI:73511
MDL Number	MFCD00066346
SMILES	C#CCCCC(=O)O
Synonym	5-hexynoic acid,5-hexyn-1-oic acid,4-ethynylbutyric acid,acmc-1an4h
IUPAC Name	hex-5-ynoic acid
InChI Key	VPFMEXRVUOPYRG-UHFFFAOYSA-N
Molecular Formula	C6H8O2

TraceCERT™ Fumaric Acid Solution, Certified Reference Material, MilliporeSigma™ Supelco™

This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.

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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

Tetrafluorosuccinic acid, 97%

CAS: 377-38-8 Molecular Formula: C4H2F4O4 Molecular Weight (g/mol): 190.05 MDL Number: MFCD00042430 InChI Key: YUDUFRYTKFGQCL-UHFFFAOYSA-N PubChem CID: 67833 IUPAC Name: 2,2,3,3-tetrafluorobutanedioic acid SMILES: C(=O)(C(C(C(=O)O)(F)F)(F)F)O

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Specifications

PubChem CID	67833
CAS	377-38-8
Molecular Weight (g/mol)	190.05
MDL Number	MFCD00042430
SMILES	C(=O)(C(C(C(=O)O)(F)F)(F)F)O
IUPAC Name	2,2,3,3-tetrafluorobutanedioic acid
InChI Key	YUDUFRYTKFGQCL-UHFFFAOYSA-N
Molecular Formula	C4H2F4O4

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

(2R,3S)-3-(Boc-amino)-2-hydroxy-5-methylhexanoic acid, 97%

CAS: 73397-28-1 Molecular Formula: C12H23NO5 Molecular Weight (g/mol): 261.318 MDL Number: MFCD04972275 InChI Key: DJZCWTDKDFJARG-DTWKUNHWSA-N Synonym: boc-2r,3s-3-amino-2-hydroxy-5-methylhexanoicacid,2r,3s-3-boc-amino-2-hydroxy-5-methylhexanoic acid,n-boc-2r,3s-2-hydroxy-3-amino-5-methylhexanoic acid,2r,3s-3-tert-butoxycarbonyl amino-2-hydroxy-5-methylhexanoic acid,2r,3s-2-hydroxy-3-tert-butoxycarbonylamino-5-methylhexanoic acid PubChem CID: 10377964 IUPAC Name: (2R,3S)-2-hydroxy-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid SMILES: CC(C)CC(C(C(=O)O)O)NC(=O)OC(C)(C)C

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Specifications

PubChem CID	10377964
CAS	73397-28-1
Molecular Weight (g/mol)	261.318
MDL Number	MFCD04972275
SMILES	CC(C)CC(C(C(=O)O)O)NC(=O)OC(C)(C)C
Synonym	boc-2r,3s-3-amino-2-hydroxy-5-methylhexanoicacid,2r,3s-3-boc-amino-2-hydroxy-5-methylhexanoic acid,n-boc-2r,3s-2-hydroxy-3-amino-5-methylhexanoic acid,2r,3s-3-tert-butoxycarbonyl amino-2-hydroxy-5-methylhexanoic acid,2r,3s-2-hydroxy-3-tert-butoxycarbonylamino-5-methylhexanoic acid
IUPAC Name	(2R,3S)-2-hydroxy-5-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid
InChI Key	DJZCWTDKDFJARG-DTWKUNHWSA-N
Molecular Formula	C12H23NO5

(R)-N-BOC-Allylglycine, 95%, 98% ee

CAS: 170899-08-8 Molecular Formula: C₁₀H₁₇NO₄ Molecular Weight (g/mol): 215.25 MDL Number: MFCD01320882 InChI Key: BUPDPLXLAKNJMI-SSDOTTSWSA-N Synonym: boc-d-allylglycine,r-2-tert-butoxycarbonyl amino pent-4-enoic acid,boc-alpha-allyl-d-gly,boc-d-allyglycine.dcha,2r-2-tert-butoxycarbonyl amino pent-4-enoic acid,4-pentenoic acid, 2-1,1-dimethylethoxy carbonyl amino-, 2r,boc-d-allylglycine.dcha,d-boc-allylglycine,boc-d-allyglycine?dcha,boc-d-allyglycine?cha PubChem CID: 638723 IUPAC Name: (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-enoic acid SMILES: CC(C)(C)OC(=O)NC(CC=C)C(=O)O

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Specifications

PubChem CID	638723
CAS	170899-08-8
Molecular Weight (g/mol)	215.25
MDL Number	MFCD01320882
SMILES	CC(C)(C)OC(=O)NC(CC=C)C(=O)O
Synonym	boc-d-allylglycine,r-2-tert-butoxycarbonyl amino pent-4-enoic acid,boc-alpha-allyl-d-gly,boc-d-allyglycine.dcha,2r-2-tert-butoxycarbonyl amino pent-4-enoic acid,4-pentenoic acid, 2-1,1-dimethylethoxy carbonyl amino-, 2r,boc-d-allylglycine.dcha,d-boc-allylglycine,boc-d-allyglycine?dcha,boc-d-allyglycine?cha
IUPAC Name	(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-enoic acid
InChI Key	BUPDPLXLAKNJMI-SSDOTTSWSA-N
Molecular Formula	C₁₀H₁₇NO₄

Fatty acid conjugates

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