CHEBI:223548 - Ganodermalactone M

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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 Ganodermalactone M
ChEBI ID CHEBI:223548
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C32H44O6
Net Charge 0
Average Mass 524.698
Monoisotopic Mass 524.31379
InChI InChI=1S/C32H44O6/c1-19-8-10-25(37-28(19)35)20(2)22-12-15-31(7)23-9-11-26-29(4,5)38-27(34)14-17-32(26,18-36-21(3)33)24(23)13-16-30(22,31)6/h8-9,13,20,22,25-26H,10-12,14-18H2,1-7H3/t20-,22+,25-,26-,30+,31-,32-/m0/s1
InChIKey DFXIWQLDBHKBKV-UANBTYQASA-N
SMILES O=C1OC([C@@H]2CC=C3C([C@]2(CC1)COC(=O)C)=CC[C@]4([C@]3(CC[C@@H]4[C@@H]([C@H]5OC(=O)C(C)=CC5)C)C)C)(C)C
Metabolite of Species Details
Tomophagusspecies (NCBI:txid2782489) See: PubMed
ChEBI Ontology
Outgoing Ganodermalactone M (CHEBI:223548) is a triterpenoid (CHEBI:36615)
IUPAC Name
[(1R,3aR,5aR,10aR,12aR)-3a,6,6,12a-tetramethyl-1-[(1S)-1-[(2S)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-8-oxo-1,2,3,5,5a,9,10,12-octahydroindeno[5,4-g][2]benzoxepin-10a-yl]methyl acetate