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CHEBI:207009 - Ganoleuconin P

Default Structure
ChEBI IDCHEBI:207009
ChEBI NameGanoleuconin P
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC51H74O8
Net Charge0
Average Mass815.145
Monoisotopic Mass814.53837
SMILESCC(C)=CCC/C(C)=C/CC/C(=C/Cc1cc(O)ccc1O)C(=O)OC[C@@](C)(O)[C@@H](O)CC[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3=O
InChIInChI=1S/C51H74O8/c1-32(2)13-11-14-33(3)15-12-16-35(18-19-36-29-37(52)20-21-40(36)53)46(57)59-31-51(10,58)44(56)22-17-34(4)38-23-28-50(9)45-39(24-27-49(38,50)8)48(7)26-25-43(55)47(5,6)42(48)30-41(45)54/h13,15,18,20-21,29,34,38,42,44,52-53,56,58H,11-12,14,16-17,19,22-28,30-31H2,1-10H3/b33-15+,35-18-/t34-,38-,42+,44+,48-,49-,50+,51-/m1/s1
InChIKeyMWKCVDOKQBMXSE-BVTKDRHKSA-N
Species of MetaboliteComponentSourceComments
Ganoderma leucocontextum (ncbitaxon:1566825) - PubMed (26287401)
ChEBI Ontology
Outgoing Relation(s)
Ganoleuconin P (CHEBI:207009) is a triterpenoid (CHEBI:36615)
IUPAC Name 
[(2R,3S,6R)-2,3-dihydroxy-2-methyl-6-[(5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-3,7-dioxo-2,5,6,11,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]heptyl] (2Z,5E)-2-[2-(2,5-dihydroxyphenyl)ethylidene]-6,10-dimethylundeca-5,9-dienoate
Manual XrefsDatabases
59004370ChemSpider