Arbutin

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Systematic / IUPAC Name: 4-Hydroxyphenyl β-D-glucopyranoside

ID: Reference1518

Other Names: p-Hydroxyphenyl β-D-glucoside;
p-Hydroxyphenyl β-D-glucopyranoside;
β-D-Glucopyranoside, 4-hydroxyphenyl;
(2R,3S,4S,5R,6S)-2-(Hydroxymethyl)-6-(4-hydroxyphenoxy)oxane-3,4,5-triol;
Ursin ; more

Formula: C12H16O7

Class: Endogenous Metabolites

Spectral Data

Arbutin 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
No. of Spectral Trees 1
No. of Spectra 45
Tandem Spectra MS1, MS2, MS3
Ionization Methods ESI
Analyzers FT
Last Modification 12/3/2014 7:48:35 AM
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Identificators

InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
InChI Key BJRNKVDFDLYUGJ-RMPHRYRLSA-N
Canonical SMILES C1=CC(=CC=C1O)OC2C(C(C(C(O2)CO)O)O)O
CAS 497767
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Other Names p-Hydroxyphenyl β-D-glucoside;
p-Hydroxyphenyl β-D-glucopyranoside;
β-D-Glucopyranoside, 4-hydroxyphenyl;
(2R,3S,4S,5R,6S)-2-(Hydroxymethyl)-6-(4-hydroxyphenoxy)oxane-3,4,5-triol;
Ursin;
Uvasol;
Arbutoside;
β-Arbutin;
Hydroquinone-O-β-D-glucopyranoside

In Other Databases

Wikipedia Arbutin
ChemSpider 389765
PubChem 440936
ChEMBL CHEMBL232202
ChEBI CHEBI:18305
KEGG C06186