CHEBI:61312 - 5-hydroxypseudobaptigenin

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ChEBI Name 5-hydroxypseudobaptigenin
ChEBI ID CHEBI:61312
Definition A member of the class of 7-hydroxyisoflavones that is pseudobaptigenin substituted by hydroxy group at position 5.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
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Formula C16H10O6
Net Charge 0
Average Mass 298.24700
Monoisotopic Mass 298.04774
InChI InChI=1S/C16H10O6/c17-9-4-11(18)15-14(5-9)20-6-10(16(15)19)8-1-2-12-13(3-8)22-7-21-12/h1-6,17-18H,7H2
InChIKey BNFXYMBRFDJYCH-UHFFFAOYSA-N
SMILES Oc1cc(O)c2c(c1)occ(-c1ccc3OCOc3c1)c2=O
ChEBI Ontology
Outgoing 5-hydroxypseudobaptigenin (CHEBI:61312) has functional parent pseudobaptigenin (CHEBI:8602)
5-hydroxypseudobaptigenin (CHEBI:61312) is a 7-hydroxyisoflavones (CHEBI:55465)
5-hydroxypseudobaptigenin (CHEBI:61312) is a benzodioxoles (CHEBI:38298)
5-hydroxypseudobaptigenin (CHEBI:61312) is conjugate acid of 5-hydroxypseudobaptigenin(1−) (CHEBI:61339)
Incoming 5-hydroxypseudobaptigenin(1−) (CHEBI:61339) is conjugate base of 5-hydroxypseudobaptigenin (CHEBI:61312)
IUPAC Name
3-(1,3-benzodioxol-5-yl)-5,7-dihydroxy-4H-chromen-4-one
Synonyms Sources
3-(1,3-benzodioxol-5-yl)-5,7-dihydroxy-4H-1-benzopyran-4-one ChEBI
3-(benzo[d][1,3]dioxol-5-yl)-5,7-dihydroxy-4H-chromen-4-one ChEBI
5,7-dihydroxy-3',4'-(methylenedioxy)isoflavone ChEBI
Manual Xrefs Databases
CPD-12508 MetaCyc
LMPK12050252 LIPID MAPS
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Registry Number Type Source
309023 Reaxys Registry Number Reaxys
Last Modified
12 March 2013