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CHEBI:175748 - Ganoderiol A

Default Structure
ChEBI IDCHEBI:175748
ChEBI NameGanoderiol A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H50O4
Net Charge0
Average Mass474.726
Monoisotopic Mass474.37091
SMILES[H][C@@]12CC=C3C(=CC[C@@]4(C)[C@@]3(C)CC[C@]4([H])[C@H](C)CC[C@H](O)C(C)(O)CO)[C@@]1(C)CC[C@H](O)C2(C)C
InChIInChI=1S/C30H50O4/c1-19(8-11-25(33)30(7,34)18-31)20-12-16-29(6)22-9-10-23-26(2,3)24(32)14-15-27(23,4)21(22)13-17-28(20,29)5/h9,13,19-20,23-25,31-34H,8,10-12,14-18H2,1-7H3/t19-,20-,23+,24+,25+,27-,28-,29+,30?/m1/s1
InChIKeyVMEFPSOTFFVAQJ-OBGNTNONSA-N
ChEBI Ontology
Outgoing Relation(s)
Ganoderiol A (CHEBI:175748) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(3S,6R)-6-[(3S,5R,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methylheptane-1,2,3-triol
Manual XrefsDatabases
58828539ChemSpider
Registry NumbersSources
CAS:106518-61-0ChemIDplus