CHEBI:165299 - 11-Deoxy-11-methylene-15-keto-PGD2

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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 11-Deoxy-11-methylene-15-keto-PGD2
ChEBI ID CHEBI:165299
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H32O4
Net Charge 0
Average Mass 348.483
Monoisotopic Mass 348.23006
InChI InChI=1S/C21H32O4/c1-3-4-7-10-17(22)13-14-18-16(2)15-20(23)19(18)11-8-5-6-9-12-21(24)25/h5,8,13-14,18-20,23H,2-4,6-7,9-12,15H2,1H3,(H,24,25)/b8-5-,14-13+/t18-,19+,20-/m0/s1
InChIKey SAAKCJFTIGHOEX-WQXLGBCHSA-N
SMILES O[C@@H]1[C@@H]([C@H](C(C1)=C)/C=C/C(=O)CCCCC)C/C=C\CCCC(O)=O
ChEBI Ontology
Outgoing 11-Deoxy-11-methylene-15-keto-PGD2 (CHEBI:165299) is a prostanoid (CHEBI:26347)
IUPAC Name
(Z)-7-[(1R,2R,5S)-5-hydroxy-3-methylidene-2-[(E)-3-oxooct-1-enyl]cyclopentyl]hept-5-enoic acid
Manual Xrefs Databases
4446222 ChemSpider
LMFA03010104 LIPID MAPS
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