Genistein

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Systematic / IUPAC Name: 5,7-Dihydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one

ID: Reference24

Other Names: 5,7-Dihydroxy-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one;
4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(4-hydroxyphenyl)-;
5,7-Dihydroxy-3-(4-hydroxyphenyl)chromen-4-one;
5,7-Dihydroxy-3-(4-hydroxyphenyl)-4-benzopyrone;
4,6,7-Trihydroxyisoflavone ; more

Formula: C15H10O5

Class: Endogenous Metabolites Natural Products/Medicines

Spectral Data

Genistein mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments LTQ Orbitrap XL; Orbitrap Elite; Q Exactive Orbitrap; Q Exactive Plus Orbitrap
No. of Spectral Trees 14
No. of Spectra 2250
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI; APCI; NSI
Analyzers IT; FT
Last Modification 11/1/2016 11:47:59 AM
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Identificators

InChI InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H
InChI Key TZBJGXHYKVUXJN-UHFFFAOYSA-N
Canonical SMILES C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O
CAS 446720
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Other Names 5,7-Dihydroxy-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one;
4H-1-Benzopyran-4-one, 5,7-dihydroxy-3-(4-hydroxyphenyl)-;
5,7-Dihydroxy-3-(4-hydroxyphenyl)chromen-4-one;
5,7-Dihydroxy-3-(4-hydroxyphenyl)-4-benzopyrone;
4,6,7-Trihydroxyisoflavone;
Prunetol;
Genisteol;
Sophoricol;
Genisterin;
Differenol A;
Genestein;
Bonistein;
Gen

In Other Databases

ChEBI CHEBI:28088
ChemIDPlus 000446720
ChEMBL CHEMBL44
PubChem 5280961
HMDb HMDB03217
ChemSpider 4444448
Wikipedia Genistein
KEGG C06563