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CHEBI:144084 - Z-Isohalidrysone A

Default Structure
ChEBI IDCHEBI:144084
ChEBI NameZ-Isohalidrysone A
Stars
SubmitterKeeva
DownloadsMolfile
FormulaC28H40O5
Net Charge0
Average Mass456.623
Monoisotopic Mass456.28757
SMILESCOc1cc(C)c(O)c(C/C=C(\C)CC(=O)/C=C(/C)CCCC(C)C(O)C(=O)C=C(C)C)c1
InChIInChI=1S/C28H40O5/c1-18(2)13-26(30)28(32)21(5)10-8-9-19(3)14-24(29)15-20(4)11-12-23-17-25(33-7)16-22(6)27(23)31/h11,13-14,16-17,21,28,31-32H,8-10,12,15H2,1-7H3/b19-14-,20-11+
InChIKeyHTVAGPUQOOAAEN-PKVUCGNLSA-N
Species of MetaboliteComponentSourceComments
Halidrys siliquosa (ncbitaxon:74466) - MetaboLights (MTBLS874)
ChEBI Ontology
Outgoing Relation(s)
Z-Isohalidrysone A (CHEBI:144084) is a organic molecular entity (CHEBI:50860)