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CHEBI:191487 - Ganoderic acid Mg

Default Structure
ChEBI IDCHEBI:191487
ChEBI NameGanoderic acid Mg
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC35H54O8
Net Charge0
Average Mass602.809
Monoisotopic Mass602.38187
SMILESCOC1CC2C(C)(CCC(OC(C)=O)C2(C)C)C2=C1C1(C)C(O)CC(C(C)C(C/C=C(\C)C(=O)O)OC(C)=O)C1(C)CC2
InChIInChI=1S/C35H54O8/c1-19(31(39)40)11-12-25(42-21(3)36)20(2)24-17-28(38)35(9)30-23(13-16-34(24,35)8)33(7)15-14-29(43-22(4)37)32(5,6)27(33)18-26(30)41-10/h11,20,24-29,38H,12-18H2,1-10H3,(H,39,40)/b19-11+
InChIKeySSISLAMFCZQHEH-YBFXNURJSA-N
Species of MetaboliteComponentSourceComments
Solanum tuberosum (ncbitaxon:4113) leaf (BTO:0000713) MetaboLights (MTBLS4365)
ChEBI Ontology
Outgoing Relation(s)
Ganoderic acid Mg (CHEBI:191487) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(E)-5-acetyloxy-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
74886445ChemSpider
HMDB0035999HMDB