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CHEBI:176040 - Ganoderic acid Me

Default Structure
ChEBI IDCHEBI:176040
ChEBI NameGanoderic acid Me
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H50O6
Net Charge0
Average Mass554.768
Monoisotopic Mass554.36074
SMILESCC(=O)OC1CCC2(C)C3=CCC4(C)C(C(C)CC/C=C(\C)C(=O)O)CC(OC(C)=O)C4(C)C3=CCC2C1(C)C
InChIInChI=1S/C34H50O6/c1-20(11-10-12-21(2)30(37)38)26-19-29(40-23(4)36)34(9)25-13-14-27-31(5,6)28(39-22(3)35)16-17-32(27,7)24(25)15-18-33(26,34)8/h12-13,15,20,26-29H,10-11,14,16-19H2,1-9H3,(H,37,38)/b21-12+
InChIKeyOTUZGGSAOMCYNC-CIAFOILYSA-N
ChEBI Ontology
Outgoing Relation(s)
Ganoderic acid Me (CHEBI:176040) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(E)-6-(3,15-diacetyloxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylhept-2-enoic acid
Manual XrefsDatabases
HMDB0035333HMDB