CHEBI:15557 - 15-dehydro-prostaglandin D2

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ChEBI Name 15-dehydro-prostaglandin D2
ChEBI ID CHEBI:15557
ChEBI ASCII Name 15-dehydro-prostaglandin D2
Definition The 15-dehydro derivative of prostaglandin D2.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:249, CHEBI:10919, CHEBI:18592
Supplier Information ZINC000004632133
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Formula C20H30O5
Net Charge 0
Average Mass 350.44920
Monoisotopic Mass 350.20932
InChI InChI=1S/C20H30O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,16-18,22H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t16-,17-,18+/m1/s1
InChIKey XEQAHADLFLAPQL-RBIQQSKKSA-N
SMILES CCCCCC(=O)\C=C\[C@@H]1[C@@H](C\C=C/CCCC(O)=O)[C@@H](O)CC1=O
ChEBI Ontology
Outgoing 15-dehydro-prostaglandin D2 (CHEBI:15557) has functional parent prostaglandin D2 (CHEBI:15555)
15-dehydro-prostaglandin D2 (CHEBI:15557) is a prostaglandins D (CHEBI:26337)
15-dehydro-prostaglandin D2 (CHEBI:15557) is conjugate acid of 15-dehydro-prostaglandin D2(1−) (CHEBI:57408)
Incoming 15-dehydro-prostaglandin D2(1−) (CHEBI:57408) is conjugate base of 15-dehydro-prostaglandin D2 (CHEBI:15557)
IUPAC Name
(5Z,13E)-9α-hydroxy-11,15-dioxoprosta-5,13-dienoic acid
Synonyms Sources
(5Z,13E)-9alpha-Hydroxy-11,15-dioxoprosta-5,13-dienoate KEGG COMPOUND
15-Dehydro-prostaglandin D2 KEGG COMPOUND
15-deoxy-15-oxo-prostaglandin D2 ChEBI
Manual Xref Database
C04758 KEGG COMPOUND
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Last Modified
28 July 2014