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CHEBI:226728 - Ganodermalactone W

Default Structure
ChEBI IDCHEBI:226728
ChEBI NameGanodermalactone W
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H42O4
Net Charge0
Average Mass466.662
Monoisotopic Mass466.30831
SMILESCC1=CC[C@@H]([C@@H](C)[C@H]2CC[C@@]3(C)C4=C(CC[C@]23C)[C@]23CC[C@@H](OC2=O)C(C)(C)[C@@H]3CC4)OC1=O
InChIInChI=1S/C30H42O4/c1-17-7-9-22(33-25(17)31)18(2)19-11-14-29(6)20-8-10-23-27(3,4)24-13-16-30(23,26(32)34-24)21(20)12-15-28(19,29)5/h7,18-19,22-24H,8-16H2,1-6H3/t18-,19+,22-,23-,24+,28+,29-,30-/m0/s1
InChIKeyAEHQRZIZRASHSX-PNLPGUNJSA-N
Species of MetaboliteComponentSourceComments
Ganoderma colossus (ncbitaxon:36070) - PubMed (32639735)
Roles Classification
Biological Role:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
Ganodermalactone W (CHEBI:226728) is a withanolide (CHEBI:74716)
IUPAC Name 
(1R,5R,6R,9R,13S,15R)-5,9,14,14-tetramethyl-6-[(1S)-1-[(2S)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-16-oxapentacyclo[13.2.2.01,13.02,10.05,9]nonadec-2(10)-en-17-one