(2S)-5,7-dimethoxy-8-formylflavanone (CHEBI:65795)

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ChEBI Name	(2S)-5,7-dimethoxy-8-formylflavanone

ChEBI ID	CHEBI:65795

ChEBI ASCII Name	(2S)-5,7-dimethoxy-8-formylflavanone

Definition	A dimethoxyflavanone that is 5,7-dimethoxyflavanone substituted by a formyl group at position 8. Isolated from the stem bark of Pongamia pinnata, it acts as a an inducer of quinone reductase, a phase II enzyme that protects cells against reactive, toxic and potentially carcinogenic species.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C18H16O5

Net Charge

Average Mass

312.31660

Monoisotopic Mass

312.09977

InChI

InChI=1S/C18H16O5/c1-21-15-9-16(22-2)17-13(20)8-14(11-6-4-3-5-7-11)23-18(17)12(15)10-19/h3-7,9-10,14H,8H2,1-2H3/t14-/m0/s1

InChIKey

FHKQMPVRIQJSEJ-AWEZNQCLSA-N

SMILES

COc1cc(OC)c2C(=O)C[C@H](Oc2c1C=O)c1ccccc1

Metabolite of Species	Details
Pongamia pinnata (NCBI:txid56065)	Found in stem (BTO:0001300). Previous component: stem bark; See: PubMed

Roles Classification
Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	(2S)-5,7-dimethoxy-8-formylflavanone (CHEBI:65795) has role antineoplastic agent (CHEBI:35610) (2S)-5,7-dimethoxy-8-formylflavanone (CHEBI:65795) has role metabolite (CHEBI:25212) (2S)-5,7-dimethoxy-8-formylflavanone (CHEBI:65795) is a aldehyde (CHEBI:17478) (2S)-5,7-dimethoxy-8-formylflavanone (CHEBI:65795) is a dimethoxyflavanone (CHEBI:38743)

IUPAC Name

(2S)-5,7-dimethoxy-4-oxo-2-phenyl-3,4-dihydro-2H-chromene-8-carbaldehyde

Registry Number	Type	Source
9786124	Reaxys Registry Number	Reaxys

Citation	Type	Source
14510596	PubMed citation	Europe PMC

Last Modified

11 March 2013