Daidzein

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Systematic / IUPAC Name: 7-Hydroxy-3-(4-hydroxyphenyl)-4H-chromen-4-one

ID: Reference680

Other Names: 7-Hydroxy-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one;
4H-1-Benzopyran-4-one, 7-hydroxy-3-(4-hydroxyphenyl)-;
Daidzeol;
Isoaurostatin;
Diadzein

Formula: C15H10O4

Class: Endogenous Metabolites Natural Products/Medicines

Spectral Data

Daidzein 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 Orbitrap Fusion Lumos with ETD LBP FAIMS ; Q Exactive Orbitrap
No. of Spectral Trees 6
No. of Spectra 691
Tandem Spectra MS1, MS2
Ionization Methods ESI; APCI; NSI
Analyzers FT
Last Modification 2/19/2015 3:36:27 PM
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Identificators

InChI InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H
InChI Key ZQSIJRDFPHDXIC-UHFFFAOYSA-N
Canonical SMILES C1=CC(=CC=C1C2=COC3=C(C2=O)C=CC(=C3)O)O
CAS 486668
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Other Names 7-Hydroxy-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one;
4H-1-Benzopyran-4-one, 7-hydroxy-3-(4-hydroxyphenyl)-;
Daidzeol;
Isoaurostatin;
Diadzein

In Other Databases

ChemSpider 4445025
HMDb HMDB03312
ChemIDPlus 000486668
ChEMBL CHEMBL8145
Wikipedia Daidzein
PubChem 5281708
KEGG C10208
ChEBI CHEBI:28197