CHEBI:144085 - E-Halidrysone A

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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 E-Halidrysone A
ChEBI ID CHEBI:144085
Stars This entity has been manually annotated by a third party.
Submitter Keeva Cochrane
Supplier Information
Download Molfile XML SDF
Formula C28H40O5
Net Charge 0
Average Mass 456.623
Monoisotopic Mass 456.28757
InChI InChI=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/h11,13-14,16-17,21,26,30-31H,8-10,12,15H2,1-7H3/b19-14+,20-11+
InChIKey HBKSTRSDLUAESY-XNXVHQMYSA-N
SMILES OC1=C(C/C=C(\C)/CC(/C=C(\C)/CCCC(C)C(C(O)C=C(C)C)=O)=O)C=C(OC)C=C1C
Metabolite of Species Details
Halidrys siliquosa (NCBI:txid74466) See: MetaboLights Study
ChEBI Ontology
Outgoing E-Halidrysone A (CHEBI:144085) is a organic molecular entity (CHEBI:50860)