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CHEBI:210129 - Guignardone S

ChEBI IDCHEBI:210129
ChEBI NameGuignardone S
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H24O4
Net Charge0
Average Mass292.375
Monoisotopic Mass292.16746
SMILESCO[C@H]1C[C@H](O)C2=C(C[C@H]3C(=C(C)C)CC[C@@]3(C)O2)C1=O
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/h12-14,18H,5-8H2,1-4H3/t12-,13-,14-,17+/m0/s1
InChIKeyRBASAPJSIRHPNL-AYMQEEERSA-N
Species of MetaboliteComponentSourceComments
Guignardia (ncbitaxon:55180) - PubMed (26703548)
ChEBI Ontology
Outgoing Relation(s)
Guignardone S (CHEBI:210129) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
(3aR,5S,7S,9aS)-5-hydroxy-7-methoxy-3a-methyl-1-propan-2-ylidene-3,5,6,7,9,9a-hexahydro-2H-cyclopenta[b]chromen-8-one
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78441302ChemSpider