Desepoxy-4,5-didehydromethylenomycin A (CHEBI:208360)

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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	Desepoxy-4,5-didehydromethylenomycin A

ChEBI ID	CHEBI:208360

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

Submitter	MetaboLights

Supplier Information	ChemicalBook:CB5855401, ZINC000005854633

Download	Molfile XML SDF

Formula

C9H10O3

Net Charge

Average Mass

166.176

Monoisotopic Mass

166.06299

InChI

InChI=1S/C9H10O3/c1-4-5(2)8(10)6(3)7(4)9(11)12/h7H,3H2,1-2H3,(H,11,12)/t7-/m0/s1

InChIKey

YVQOPMVVZGYOBC-ZETCQYMHSA-N

SMILES

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

Metabolite of Species	Details
Streptomyces coelicolor (NCBI:txid1902)	See: DOI

ChEBI Ontology
Outgoing	Desepoxy-4,5-didehydromethylenomycin A (CHEBI:208360) is a cyclic ketone (CHEBI:3992)

IUPAC Name

(1S)-2,3-dimethyl-5-methylidene-4-oxocyclopent-2-ene-1-carboxylic acid