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CHEBI:218116 - Ganoleucoin W

Default Structure
ChEBI IDCHEBI:218116
ChEBI NameGanoleucoin W
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H42O8
Net Charge0
Average Mass530.658
Monoisotopic Mass530.28797
SMILESCC(=CCC[C@@H](C)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)[C@@H](O)[C@]12C)[C@@]1(C)CC[C@@H](O)[C@](C)(CO)[C@@H]1CC3=O)C(=O)O
InChIInChI=1S/C30H42O8/c1-15(8-7-9-16(2)26(37)38)17-12-21(34)30(6)22-18(32)13-19-27(3,11-10-20(33)28(19,4)14-31)23(22)24(35)25(36)29(17,30)5/h9,15,17,19-20,25,31,33,36H,7-8,10-14H2,1-6H3,(H,37,38)/t15-,17-,19-,20-,25-,27+,28-,29+,30+/m1/s1
InChIKeyVNOIWHRRFVTZJT-LZLZEIBYSA-N
Species of MetaboliteComponentSourceComments
Ganoderma leucocontextum (ncbitaxon:1566825) - PubMed (30145334)
ChEBI Ontology
Outgoing Relation(s)
Ganoleucoin W (CHEBI:218116) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(6R)-6-[(3R,4S,5R,10S,12S,13R,14R,17R)-3,12-dihydroxy-4-(hydroxymethyl)-4,10,13,14-tetramethyl-7,11,15-trioxo-1,2,3,5,6,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid