Apigetrin

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Systematic / IUPAC Name: 5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-7-yl β-D-glucopyranoside

ID: Reference8093

Other Names: 7-O-β-D-Glucosylapigenin;
Apigenin 7-β-D-glucoside;
Apigenin 7-O-β-D-glucopyranoside;
Apigenin 7-O-β-D-glucoside;
Apigenin 7-O-β-glucoside ; more

Formula: C21H20O10

Spectral Data

Apigetrin 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
No. of Spectral Trees 1
No. of Spectra 395
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 7/18/2018 6:54:07 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1
InChI Key KMOUJOKENFFTPU-QNDFHXLGSA-N
Canonical SMILES C1=CC(=CC=C1C2=CC(=O)C3=C(C=C(C=C3O2)OC4C(C(C(C(O4)CO)O)O)O)O)O
CAS
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Other Names 7-O-β-D-Glucosylapigenin;
Apigenin 7-β-D-glucoside;
Apigenin 7-O-β-D-glucopyranoside;
Apigenin 7-O-β-D-glucoside;
Apigenin 7-O-β-glucoside;
Apigenin 7-b-D-glucoside;
Apigenin 7-glucoside;
Cosmetin;
Cosmociin;
Cosmosiin;
Cosmosiine;
Cosmosioside;
Thalictiin;
4H-1-Benzopyran-4-one,7-(b-D-glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-;
5-Hydroxy-2-(4-hydroxyphenyl)-7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one;
5-Hydroxy-2-(4-hydroxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one;
7-(β-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one;
7-O-β-D-Glucosyl-5,7,4'-trihydroxyflavone

In Other Databases

Wikipedia Apigetrin
ChEBI CHEBI:16778
ChemSpider 4444290; 4532607; 21166990
ChEMBL CHEMBL487017
PubChem 5280704
KEGG C04608