CHEBI:140267 - prostaglandin J3

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ChEBI Name prostaglandin J3
ChEBI ID CHEBI:140267
ChEBI ASCII Name prostaglandin J3
Definition A member of the class of prostaglandins J that is (5Z,9Z,13E,17Z)-prostatetraenoic acid carrying hydroxy and oxo substituents at positions 11 and 15 respectively. An intermediate of specialised proresolving mediators
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Bijay
Supplier Information
Download Molfile XML SDF
Formula C20H28O4
Net Charge 0
Average Mass 332.435
Monoisotopic Mass 332.19876
InChI InChI=1S/C20H28O4/c1-2-3-6-10-17(21)13-14-18-16(12-15-19(18)22)9-7-4-5-8-11-20(23)24/h3-4,6-7,12-18,21H,2,5,8-11H2,1H3,(H,23,24)/b6-3-,7-4-,14-13+/t16-,17-,18+/m0/s1
InChIKey DIBKBAMSPPKSTJ-BAILPSPNSA-N
SMILES C(CCC(O)=O)/C=C\C[C@@H]1[C@H](C(C=C1)=O)/C=C/[C@H](C/C=C\CC)O
Metabolite of Species Details
Homo sapiens (NCBI:txidtxid9606) See: PubMed
Roles Classification
Biological Role(s): human xenobiotic metabolite
Any human metabolite produced by metabolism of a xenobiotic compound in humans.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing prostaglandin J3 (CHEBI:140267) has role antineoplastic agent (CHEBI:35610)
prostaglandin J3 (CHEBI:140267) has role human xenobiotic metabolite (CHEBI:76967)
prostaglandin J3 (CHEBI:140267) is a prostaglandins J (CHEBI:26346)
prostaglandin J3 (CHEBI:140267) is a secondary allylic alcohol (CHEBI:134396)
prostaglandin J3 (CHEBI:140267) is conjugate acid of prostaglandin J3(1−) (CHEBI:140285)
Incoming Δ12-prostaglandin J3 (CHEBI:140274) has functional parent prostaglandin J3 (CHEBI:140267)
prostaglandin J3(1−) (CHEBI:140285) is conjugate base of prostaglandin J3 (CHEBI:140267)
IUPAC Name
(5Z)-7-{(1S,5R)-5-[(1E,3S,5Z)-3-hydroxyocta-1,5-dien-1-yl]-4-oxocyclopent-2-en-1-yl}hept-5-enoic acid
Synonyms Sources
(5Z,9Z,13E,15S,17Z)-15-hydroxy-11-oxoprostatetraenoic acid ChEBI
15S-hydroxy-11-oxo-5Z,9Z,13E,17Z-prostatetraenoic acid LIPID MAPS
PGJ3 SUBMITTER
Manual Xrefs Databases
16061112 PubChem
LMFA03010180 LIPID MAPS
View more database links
Citations Waiting for Citations Types Sources
22442337 PubMed citation Europe PMC
26339618 PubMed citation Europe PMC
Last Modified
27 February 2018