Guignardone S (CHEBI:210129)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Guignardone S

ChEBI ID	CHEBI:210129

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H24O4

Net Charge

Average Mass

292.375

Monoisotopic Mass

292.16746

InChI

InChI=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

InChIKey

RBASAPJSIRHPNL-AYMQEEERSA-N

SMILES

O=C1C2=C(O[C@@]3(CCC([C@@H]3C2)=C(C)C)C)[C@@H](O)C[C@@H]1OC

Metabolite of Species	Details
Guignardia (NCBI:txid55180)	See: PubMed

ChEBI Ontology
Outgoing	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