Sepedonin (CHEBI:226935)

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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	Sepedonin

ChEBI ID	CHEBI:226935

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

Submitter	MetaboLights

Supplier Information	ChemicalBook:CB5855401, ZINC000005854633

Download	Molfile XML SDF

Formula

C11H12O5

Net Charge

Average Mass

224.212

Monoisotopic Mass

224.06847

InChI

InChI=1S/C11H12O5/c1-11(15)4-6-2-9(13)10(14)3-8(12)7(6)5-16-11/h2-3,12,15H,4-5H2,1H3,(H,13,14)/t11-/m0/s1

InChIKey

JKLMRPSQVILGMY-NSHDSACASA-N

SMILES

O=C1C(O)=CC=2C[C@](O)(C)OCC2C(=C1)O

Metabolite of Species	Details
Hypomyces chrysospermus (NCBI:txid5131)	See: DOI

ChEBI Ontology
Outgoing	Sepedonin (CHEBI:226935) is a cyclic ketone (CHEBI:3992)

IUPAC Name

3,7,9-trihydroxy-3-methyl-1,4-dihydrocyclohepta[c]pyran-6-one