(1'Z)-dechloromycorrhizin A (CHEBI:200345)

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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	(1'Z)-dechloromycorrhizin A

ChEBI ID	CHEBI:200345

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H16O4

Net Charge

Average Mass

248.278

Monoisotopic Mass

248.10486

InChI

InChI=1S/C14H16O4/c1-4-5-8-6-10(15)13-7-9(13)12(2,3)18-14(13,17)11(8)16/h4-6,9,17H,7H2,1-3H3/b5-4-/t9-,13-,14+/m0/s1

InChIKey

PIKQVDHHJWKTME-MWXCKUNPSA-N

SMILES

O=C1C(=CC(=O)[C@@]23[C@@]1(OC(C)(C)[C@@H]2C3)O)/C=C\C

Metabolite of Species	Details
Lachnum (NCBI:txid47817)	See: PubMed

ChEBI Ontology
Outgoing	(1'Z)-dechloromycorrhizin A (CHEBI:200345) is a cyclohexenones (CHEBI:48953)

IUPAC Name

(1aR,3aS,7aS)-3a-hydroxy-2,2-dimethyl-5-[(Z)-prop-1-enyl]-1,1a-dihydrocyclopropa[c][1]benzouran-4,7-dione