CHEBI:184260 - 11-deoxy-11-methylene-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-PGD2
ChEBI ID CHEBI:184260
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H34O4
Net Charge 0
Average Mass 350.499
Monoisotopic Mass 350.24571
InChI InChI=1S/C21H34O4/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/h5,8,13-14,17-20,22-23H,2-4,6-7,9-12,15H2,1H3,(H,24,25)/b8-5-,14-13+/t17-,18-,19+,20-/m0/s1
InChIKey ROZAFJXVUNORLT-SFIVEXQWSA-N
SMILES O[C@@H]1[C@@H]([C@H](C(C1)=C)/C=C/[C@@H](O)CCCCC)C/C=C\CCCC(O)=O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in serum (BTO:0001239). See: MetaboLights Study
ChEBI Ontology
Outgoing 11-deoxy-11-methylene-PGD2 (CHEBI:184260) is a prostanoid (CHEBI:26347)
IUPAC Name
(Z)-7-[(1R,2R,5S)-5-hydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]-3-methylidenecyclopentyl]hept-5-enoic acid
Manual Xrefs Databases
4446221 ChemSpider
LMFA03010103 LIPID MAPS
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