Guignardone C (CHEBI:208173)

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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 C

ChEBI ID	CHEBI:208173

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H22O4

Net Charge

Average Mass

290.359

Monoisotopic Mass

290.15181

InChI

InChI=1S/C17H22O4/c1-9(2)10-4-5-16(3)12(10)6-11-14(18)13-7-17(19,8-20-13)15(11)21-16/h10,12-13,19H,1,4-8H2,2-3H3/t10-,12-,13-,16+,17+/m0/s1

InChIKey

DJBBHFCWBSNKEG-AWKHGQQRSA-N

SMILES

O=C1C2=C(O[C@@]3(CC[C@H]([C@@H]3C2)C(=C)C)C)[C@@]4(O)C[C@@H]1OC4

Metabolite of Species	Details
Phyllosticta capitalensis (NCBI:txid121624)	See: DOI

ChEBI Ontology
Outgoing	Guignardone C (CHEBI:208173) is a cyclohexenones (CHEBI:48953)

IUPAC Name

(1R,4R,7R,8S,12S)-1-hydroxy-4-methyl-7-prop-1-en-2-yl-3,13-dioxatetracyclo[10.2.1.02,10.04,8]pentadec-2(10)-en-11-one