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CHEBI:175522 - Ganoderal A

Default Structure
ChEBI IDCHEBI:175522
ChEBI NameGanoderal A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H44O2
Net Charge0
Average Mass436.680
Monoisotopic Mass436.33413
SMILES[H][C@@]12CC=C3C(=CC[C@@]4(C)[C@@]3(C)CC[C@]4([H])[C@H](C)CC/C=C(\C)C=O)[C@@]1(C)CCC(=O)C2(C)C
InChIInChI=1S/C30H44O2/c1-20(19-31)9-8-10-21(2)22-13-17-30(7)24-11-12-25-27(3,4)26(32)15-16-28(25,5)23(24)14-18-29(22,30)6/h9,11,14,19,21-22,25H,8,10,12-13,15-18H2,1-7H3/b20-9+/t21-,22-,25+,28-,29-,30+/m1/s1
InChIKeyRHNFCIPJKSUUES-SPFFTVLFSA-N
ChEBI Ontology
Outgoing Relation(s)
Ganoderal A (CHEBI:175522) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(E,6R)-2-methyl-6-[(5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]hept-2-enal
Manual XrefsDatabases
10269415ChemSpider