CHEBI:191855 - 8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate

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ChEBI Name 8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate
ChEBI ID CHEBI:191855
ChEBI ASCII Name 8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate
Definition An oxo monocarboxylic acid anion that is the conjugate base of 8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid resulting from the deprotonation of the carboxy group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C18H29O3
Net Charge -1
Average Mass 293.428
Monoisotopic Mass 293.21222
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)/p-1/b7-3-/t15-,16-/m0/s1
InChIKey BZXZFDKIRZBJEP-JMTMCXQRSA-M
SMILES CC\C=C/C[C@H]1[C@@H](CCCCCCCC([O-])=O)CCC1=O
ChEBI Ontology
Outgoing 8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate (CHEBI:191855) has functional parent octanoate (CHEBI:25646)
8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate (CHEBI:191855) is a oxo monocarboxylic acid anion (CHEBI:35902)
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)
Incoming 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)
IUPAC Name
8-{(1S,2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoate
Synonyms Sources
(1S,2S)-OPC-8 UniProt
(1S,2S)-OPC8 anion ChEBI
8-[(1S,2S)-3-oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoate ChEBI
OPC-8:0(1−) ChEBI
Manual Xref Database
CPD-730 MetaCyc
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Last Modified
15 June 2022