Prunin

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Systematic / IUPAC Name: (2S)-5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-chromen-7-yl β-D-glucopyranoside

ID: Reference3465

Other Names: Naringenin 7-O-β-D-glucoside;
Naringenin 7-glucoside;
Naringenin-7-O-glucoside;
(S)-7-(β-D-Glucopyranosyloxy)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

Formula: C21H22O10

Class: Endogenous Metabolites

Spectral Data

Prunin 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 Elite
No. of Spectral Trees 2
No. of Spectra 2103
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers IT; FT
Last Modification 12/3/2015 1:54:19 PM
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Identificators

InChI InChI=1S/C21H22O10/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/h1-6,14,16,18-24,26-28H,7-8H2/t14-,16+,18+,19-,20+,21+/m0/s1
InChI Key DLIKSSGEMUFQOK-SFTVRKLSSA-N
Canonical SMILES C1C(OC2=CC(=CC(=C2C1=O)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC=C(C=C4)O
CAS 529555
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Other Names Naringenin 7-O-β-D-glucoside;
Naringenin 7-glucoside;
Naringenin-7-O-glucoside;
(S)-7-(β-D-Glucopyranosyloxy)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one

In Other Databases

KEGG C09099
ChemSpider 83766
Wikipedia Prunin
PubChem 92794
ChEBI CHEBI:28327
ChemIDPlus 000529555