CHEBI:184761 - ent-11-epi-8-A2-IsoP

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name ent-11-epi-8-A2-IsoP
ChEBI ID CHEBI:184761
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C20H30O4
Net Charge 0
Average Mass 334.456
Monoisotopic Mass 334.21441
InChI InChI=1S/C20H30O4/c1-2-3-6-9-16-12-15-19(22)18(16)14-13-17(21)10-7-4-5-8-11-20(23)24/h4,7,12-18,21H,2-3,5-6,8-11H2,1H3,(H,23,24)/b7-4-,14-13+/t16-,17+,18+/m0/s1
InChIKey WCMBVZNXINALLE-ZGCAFGAXSA-N
SMILES O=C1[C@@H]([C@@H](CCCCC)C=C1)/C=C/[C@H](O)C/C=C\CCCC(O)=O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study
ChEBI Ontology
Outgoing ent-11-epi-8-A2-IsoP (CHEBI:184761) is a carbonyl compound (CHEBI:36586)
IUPAC Name
(5Z,8R,9E)-8-hydroxy-10-[(1R,5S)-2-oxo-5-pentylcyclopent-3-en-1-yl]deca-5,9-dienoic acid
Manual Xrefs Databases
113369691 ChemSpider
LMFA03110267 LIPID MAPS
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