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CHEBI:205338 - Ganodermalactone A

Default Structure
ChEBI IDCHEBI:205338
ChEBI NameGanodermalactone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H40O3
Net Charge0
Average Mass448.647
Monoisotopic Mass448.29775
SMILESCC1=CC[C@@H]([C@@H](C)[C@H]2CC[C@@]3(C)C4=C(C=C5C=CC(=O)C(C)(C)[C@@H]5CC4)CC[C@]23C)OC1=O
InChIInChI=1S/C30H40O3/c1-18-7-11-25(33-27(18)32)19(2)22-14-16-30(6)24-10-9-23-20(8-12-26(31)28(23,3)4)17-21(24)13-15-29(22,30)5/h7-8,12,17,19,22-23,25H,9-11,13-16H2,1-6H3/t19-,22+,23+,25-,29+,30-/m0/s1
InChIKeyIDZRCTSIODKGSC-WJDWYOEMSA-N
Species of MetaboliteComponentSourceComments
Ganoderma (ncbitaxon:5314) - PubMed (24992637)
ChEBI Ontology
Outgoing Relation(s)
Ganodermalactone A (CHEBI:205338) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(2S)-5-methyl-2-[(1S)-1-[(8R,12R,15R,16R)-7,7,12,16-tetramethyl-6-oxo-15-tetracyclo[9.7.0.03,8.012,16]octadeca-1(11),2,4-trienyl]ethyl]-2,3-dihydropyran-6-one
Manual XrefsDatabases
78437269ChemSpider