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CHEBI:204158 - Guignarenone C

ChEBI IDCHEBI:204158
ChEBI NameGuignarenone C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H24O4
Net Charge0
Average Mass292.375
Monoisotopic Mass292.16746
SMILESC=C(C)[C@@H]1CC[C@@]2(C)OC3=C(C[C@@H]12)C(=O)[C@@H](OC)C[C@H]3O
InChIInChI=1S/C17H24O4/c1-9(2)10-5-6-17(3)12(10)7-11-15(19)14(20-4)8-13(18)16(11)21-17/h10,12-14,18H,1,5-8H2,2-4H3/t10-,12-,13+,14-,17+/m0/s1
InChIKeyHIYHCUOXLSUVIZ-OBSCOMINSA-N
Species of MetaboliteComponentSourceComments
Phyllosticta capitalensis (ncbitaxon:121624) - DOI (10.1002/ejoc.201000916)
ChEBI Ontology
Outgoing Relation(s)
Guignarenone C (CHEBI:204158) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(1R,3aR,5R,7S,9aS)-5-hydroxy-7-methoxy-3a-methyl-1-prop-1-en-2-yl-1,2,3,5,6,7,9,9a-octahydrocyclopenta[b]chromen-8-one
Manual XrefsDatabases
78439677ChemSpider