Leptosphaerone C (CHEBI:214001)

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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	Leptosphaerone C

ChEBI ID	CHEBI:214001

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C8H12O3

Net Charge

Average Mass

156.181

Monoisotopic Mass

156.07864

InChI

InChI=1S/C8H12O3/c1-5-3-6(9)8(2,11)7(10)4-5/h3,7,10-11H,4H2,1-2H3/t7-,8-/m1/s1

InChIKey

JPANATRWCFTRDD-HTQZYQBOSA-N

SMILES

O=C1C=C(C[C@H]([C@@]1(O)C)O)C

Metabolite of Species	Details
Penicillium (NCBI:txid5073)	See: PubMed

ChEBI Ontology
Outgoing	Leptosphaerone C (CHEBI:214001) is a cyclohexenones (CHEBI:48953)

IUPAC Name

(5R,6S)-5,6-dihydroxy-3,6-dimethylcyclohex-2-en-1-one