methyl (1S,5S)-5-chloro-2-[(Z)-1-chloroprop-1-enyl]-1-hydroxy-4-oxocyclopent-2-ene-1-carboxylate (CHEBI:206965)

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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	methyl (1S,5S)-5-chloro-2-[(Z)-1-chloroprop-1-enyl]-1-hydroxy-4-oxocyclopent-2-ene-1-carboxylate

ChEBI ID	CHEBI:206965

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

Submitter	MetaboLights

Supplier Information

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Formula

C10H10Cl2O4

Net Charge

Average Mass

265.090

Monoisotopic Mass

263.99561

InChI

InChI=1S/C10H10Cl2O4/c1-3-6(11)5-4-7(13)8(12)10(5,15)9(14)16-2/h3-4,8,15H,1-2H3/b6-3-/t8-,10-/m1/s1

InChIKey

AQUWOLOJGKVYPK-VDKVCSQUSA-N

SMILES

Cl/C(/C1=CC(=O)[C@H]([C@@]1(O)C(=O)OC)Cl)=C\C

Metabolite of Species	Details
Dasyscyphus (NCBI:txid318839)	See: PubMed

ChEBI Ontology
Outgoing	methyl (1S,5S)-5-chloro-2-[(Z)-1-chloroprop-1-enyl]-1-hydroxy-4-oxocyclopent-2-ene-1-carboxylate (CHEBI:206965) is a tertiary alcohol (CHEBI:26878)

IUPAC Name

methyl (1S,5S)-5-chloro-2-[(Z)-1-chloroprop-1-enyl]-1-hydroxy-4-oxocyclopent-2-ene-1-carboxylate