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CHEBI:209974 - Ganodernoid E

Default Structure
ChEBI IDCHEBI:209974
ChEBI NameGanodernoid E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H46O8
Net Charge0
Average Mass546.701
Monoisotopic Mass546.31927
SMILESCOC(=O)C(C)CC(=O)C[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)(C)[C@@H]1C[C@@H]3O
InChIInChI=1S/C31H46O8/c1-15(11-17(32)12-16(2)27(38)39-8)18-13-22(35)31(7)23-19(33)14-20-28(3,4)21(34)9-10-29(20,5)24(23)25(36)26(37)30(18,31)6/h15-16,18-21,26,33-34,37H,9-14H2,1-8H3/t15-,16?,18-,19+,20+,21+,26+,29+,30+,31+/m1/s1
InChIKeyQIZQYDGATDXOSJ-IPNNGCFOSA-N
Species of MetaboliteComponentSourceComments
Ganoderma lucidum (ncbitaxon:5315) - PubMed (26222905)
ChEBI Ontology
Outgoing Relation(s)
Ganodernoid E (CHEBI:209974) is a triterpenoid (CHEBI:36615)
IUPAC Name 
methyl (6R)-2-methyl-4-oxo-6-[(3S,5R,7S,10S,12R,13R,14R,17R)-3,7,12-trihydroxy-4,4,10,13,14-pentamethyl-11,15-dioxo-2,3,5,6,7,12,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]heptanoate
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78441485ChemSpider