8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid (CHEBI:137132)

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ChEBI Name	8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid

ChEBI ID	CHEBI:137132

ChEBI ASCII Name	8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid

Definition	An 8-{3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid that has 1S,2S-configuration.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

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Formula

C18H30O3

Net Charge

Average Mass

294.435

Monoisotopic Mass

294.21949

InChI

InChI=1S/C18H30O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h3,7,15-16H,2,4-6,8-14H2,1H3,(H,20,21)/b7-3-/t15-,16-/m0/s1

InChIKey

BZXZFDKIRZBJEP-JMTMCXQRSA-N

SMILES

CC\C=C/C[C@H]1[C@@H](CCCCCCCC(O)=O)CCC1=O

Metabolite of Species	Details
Zea mays (NCBI:txid4577)	See: PubMed

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology
Outgoing	8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid (CHEBI:137132) has role plant metabolite (CHEBI:76924) 8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid (CHEBI:137132) is a 8-{3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid (CHEBI:191853) 8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid (CHEBI:137132) is conjugate acid of 8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate (CHEBI:191855)

Incoming	8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate (CHEBI:191855) is conjugate base of 8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid (CHEBI:137132)

IUPAC Name

8-{(1S,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoic acid

Synonyms	Sources
(1S,2S)-3-oxo-2-(2'Z-pentenyl)-cyclopentaneoctanoic acid	LIPID MAPS
(1S,2S)-3-oxo-2-(2Z)-2-pentenyl-cyclopentaneoctanoic acid	ChEBI
(1S,2S)-OPC8	ChEBI
(9S,13S)-10,11-dihydro-12-oxo-15-phytoenoic acid	LIPID MAPS
8-[(1S,2S)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]octanoic acid	KEGG COMPOUND
OPC-8:0	KEGG COMPOUND

Registry Number	Type	Source
204135-86-4	CAS Registry Number	KNApSAcK

Citation	Type	Source
16663643	PubMed citation	Europe PMC

Last Modified

16 May 2022