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pseudobaptigenin

Go to external page http://purl.obolibrary.org/obo/CHEBI_8602

A member of the class of 7-hydroxyisoflavones that is 7-hydroxyisoflavone and in which the phenyl group at position 3 is replaced by a 1,3-benzodioxol-5-yl group.

Term info

Label

pseudobaptigenin

Synonyms
  • 3-(1,3-benzodioxol-5-yl)-7-hydroxy-4H-chromen-4-one
database cross reference
Subsets

3_STAR

IUPAC NAME
3-(1,3-benzodioxol-5-yl)-7-hydroxy-4H-chromen-4-one [ IUPAC ]

charge

0

formula

C16H10O5

has obo namespace

chebi_ontology

has related synonym

psi-baptigenin, 7-hydroxy-3',4'-(methylenedioxy)isoflavone, 3-(1,3-benzodioxol-5-yl)-7-hydroxy-4H-1-benzopyran-4-one, pseudobaptisin aglycone

id

CHEBI:8602

inchi

InChI=1S/C16H10O5/c17-10-2-3-11-14(6-10)19-7-12(16(11)18)9-1-4-13-15(5-9)21-8-20-13/h1-7,17H,8H2

inchikey

KNJNBKINYHZUGC-UHFFFAOYSA-N

mass

282.24760

monoisotopicmass

282.05282

smiles

Oc1ccc2c(c1)occ(-c1ccc3OCOc3c1)c2=O