CHEBI:15720 - 8-[(1R,2R)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 8-[(1R,2R)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate
ChEBI ID CHEBI:15720
ChEBI ASCII Name 8-[(1R,2R)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate
Definition An oxo monocarboxylic acid anion that is the conjugate base of 8-[(1R,2R)-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.
Secondary ChEBI IDs CHEBI:2326, CHEBI:20807, CHEBI:12265
Supplier Information
Download Molfile XML SDF
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-/m1/s1
InChIKey BZXZFDKIRZBJEP-GTOOTHNYSA-M
SMILES CC\C=C/C[C@@H]1[C@H](CCCCCCCC([O-])=O)CCC1=O
ChEBI Ontology
Outgoing 8-[(1R,2R)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate (CHEBI:15720) has functional parent octanoate (CHEBI:25646)
8-[(1R,2R)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate (CHEBI:15720) is a oxo monocarboxylic acid anion (CHEBI:35902)
8-[(1R,2R)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate (CHEBI:15720) is conjugate base of 8-[(1R,2R)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid (CHEBI:49265)
Incoming 8-[(1R,2R)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoic acid (CHEBI:49265) is conjugate acid of 8-[(1R,2R)-3-oxo-2-{(Z)-pent-2-en-1-yl}cyclopentyl]octanoate (CHEBI:15720)
IUPAC Name
8-[(1R,2R)-3-oxo-2-{(2Z)-pent-2-en-1-yl}cyclopentyl]octanoate
Synonyms Sources
(1R,2R)-OPC-8 UniProt
(1R,2R)-OPC8 anion ChEBI
8-[(1R,2R)-3-oxo-2-{(Z)-pent-2-enyl}cyclopentyl]octanoate KEGG COMPOUND
8-{(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}octanoate IUPAC
OPC-8:0(1−) ChEBI
Manual Xrefs Databases
4573574 ChemSpider
C22503 KEGG COMPOUND
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Last Modified
15 June 2022