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CHEBI:200421 - Gymnopilene

ChEBI IDCHEBI:200421
ChEBI NameGymnopilene
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SubmitterMetaboLights
DownloadsMolfile
FormulaC50H96O8
Net Charge0
Average Mass825.310
Monoisotopic Mass824.71052
SMILESC=CC(C)(O)CC/C=C(\C)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCC=C(C)C
InChIInChI=1S/C50H96O8/c1-13-43(5,51)26-15-24-42(4)25-16-28-45(7,53)30-18-32-47(9,55)34-20-36-49(11,57)38-22-40-50(12,58)39-21-37-48(10,56)35-19-33-46(8,54)31-17-29-44(6,52)27-14-23-41(2)3/h13,23-24,51-58H,1,14-22,25-40H2,2-12H3/b42-24+
InChIKeyMAOGWCURFNFOIO-HAPYPFFUSA-N
Species of MetaboliteComponentSourceComments
Gymnopilusspeciesctabilis (ncbitaxon:171613) - DOI (10.1021/np50073a017)
ChEBI Ontology
Outgoing Relation(s)
Gymnopilene (CHEBI:200421) is a polyterpenoid (CHEBI:26207)
IUPAC Name 
(6E)-3,7,11,15,19,23,27,31,35,39-decamethyltetraconta-1,6,38-triene-3,11,15,19,23,27,31,35-octol
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