CHEBI:206128 - Fomefficinic acid G

ChEBI IDCHEBI:206128
ChEBI NameFomefficinic acid G
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SubmitterMetaboLights
DownloadsMolfile
FormulaC31H50O4
Net Charge0
Average Mass486.737
Monoisotopic Mass486.37091
SMILESC=C(CC[C@@H](C)[C@H]1CC[C@@]2(C)C3=C(C[C@H](O)[C@]12C)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC3)C(C)C(=O)O
InChIInChI=1S/C31H50O4/c1-18(20(3)27(34)35)9-10-19(2)21-13-16-30(7)22-11-12-24-28(4,5)25(32)14-15-29(24,6)23(22)17-26(33)31(21,30)8/h19-21,24-26,32-33H,1,9-17H2,2-8H3,(H,34,35)/t19-,20?,21-,24+,25+,26+,29-,30+,31+/m1/s1
InChIKeyNRYFNXVGUMXREY-LGQLIDHKSA-N
Species of MetaboliteComponentSourceComments
Fomes (ncbitaxon:40441) - PubMed (19182411)
ChEBI Ontology
Outgoing Relation(s)
Fomefficinic acid G (CHEBI:206128) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(6R)-6-[(3S,5R,10S,12S,13R,14S,17R)-3,12-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-3-methylideneheptanoic acid
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