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CHEBI:175999 - Ganoderic acid Mj

Default Structure
ChEBI IDCHEBI:175999
ChEBI NameGanoderic acid Mj
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H52O6
Net Charge0
Average Mass544.773
Monoisotopic Mass544.37639
SMILESCOC1CC2C(C)(CCC(O)C2(C)C)C2=C1C1(C)CCC(C(C)C(C/C=C(/C)C(=O)O)OC(C)=O)C1(C)CC2
InChIInChI=1S/C33H52O6/c1-19(29(36)37)10-11-24(39-21(3)34)20(2)22-12-17-33(8)28-23(13-16-32(22,33)7)31(6)15-14-27(35)30(4,5)26(31)18-25(28)38-9/h10,20,22,24-27,35H,11-18H2,1-9H3,(H,36,37)/b19-10-
InChIKeyHOOKULHKMWTXDO-GRSHGNNSSA-N
ChEBI Ontology
Outgoing Relation(s)
Ganoderic acid Mj (CHEBI:175999) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(Z)-5-acetyloxy-6-(3-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
74886420ChemSpider
HMDB0035354HMDB