casticin (CHEBI:69355)

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ChEBI Name	casticin

ChEBI ID	CHEBI:69355

Definition	A tetramethoxyflavone that consists of quercetagetin in which the hydroxy groups at positions 3, 6, 7 and 4' have been replaced by methoxy groups. It has been isolated from Eremophila mitchellii.

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

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Formula

C19H18O8

Net Charge

Average Mass

374.34140

Monoisotopic Mass

374.10017

InChI

InChI=1S/C19H18O8/c1-23-11-6-5-9(7-10(11)20)17-19(26-4)16(22)14-12(27-17)8-13(24-2)18(25-3)15(14)21/h5-8,20-21H,1-4H3

InChIKey

PJQLSMYMOKWUJG-UHFFFAOYSA-N

SMILES

COc1ccc(cc1O)-c1oc2cc(OC)c(OC)c(O)c2c(=O)c1OC

Metabolite of Species	Details
Eremophila mitchellii (IPNI:585196-1)	Found in leaf (BTO:0000713). n-Hexane,Methylene dichloride and methanolic extarct of airdried and ground leaves See: PubMed

Roles Classification
Biological Role(s):	apoptosis inducer Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms. plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

ChEBI Ontology
Outgoing	casticin (CHEBI:69355) has functional parent quercetagetin (CHEBI:8695) casticin (CHEBI:69355) has role apoptosis inducer (CHEBI:68495) casticin (CHEBI:69355) has role plant metabolite (CHEBI:76924) casticin (CHEBI:69355) is a dihydroxyflavone (CHEBI:38686) casticin (CHEBI:69355) is a tetramethoxyflavone (CHEBI:76875)

IUPAC Name

5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxy-4H-chromen-4-one

Synonyms	Sources
3',5-dihydroxy-3,4',6,7-tetramethoxyflavone	ChemIDplus
3,6,7,4'-tetra-O-methyl-5,3'-dihydroxyflavone	LIPID MAPS
5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,6,7-trimethoxy-4H-1-benzopyran-4-one	ChemIDplus
quercetagetin 3,6,7,4'-tetramethyl ether	LIPID MAPS
vitexicarpin	ChemIDplus

Last Modified

15 January 2014