EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:175998 - Ganoderic acid Mi

Default Structure
ChEBI IDCHEBI:175998
ChEBI NameGanoderic acid Mi
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H52O6
Net Charge0
Average Mass544.773
Monoisotopic Mass544.37639
SMILESCOC1CC2C(C)(CCC(OC(C)=O)C2(C)C)C2=C1C1(C)C(O)CC(C(C)CC/C=C(/C)C(=O)O)C1(C)CC2
InChIInChI=1S/C33H52O6/c1-19(11-10-12-20(2)29(36)37)23-17-26(35)33(8)28-22(13-16-32(23,33)7)31(6)15-14-27(39-21(3)34)30(4,5)25(31)18-24(28)38-9/h12,19,23-27,35H,10-11,13-18H2,1-9H3,(H,36,37)/b20-12-
InChIKeyDOGNEMJACWRRLK-NDENLUEZSA-N
ChEBI Ontology
Outgoing Relation(s)
Ganoderic acid Mi (CHEBI:175998) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(Z)-6-(3-acetyloxy-15-hydroxy-7-methoxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylhept-2-enoic acid
Manual XrefsDatabases
74886419ChemSpider
HMDB0035340HMDB