Reynoutrin

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Systematic / IUPAC Name: 2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl D-xylopyranoside

ID: Reference3483

Other Names: Quercetin-3-D-xyloside;
Reinutrin

Formula: C20H18O11

Class: Endogenous Metabolites Excipients/Additives/Colorants Natural Products/Medicines

Spectral Data

Reynoutrin 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 1
No. of Spectra 2240
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers IT; FT
Last Modification 12/14/2015 6:49:23 AM
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Identificators

InChI InChI=1S/C20H18O11/c21-8-4-11(24)14-13(5-8)30-18(7-1-2-9(22)10(23)3-7)19(16(14)27)31-20-17(28)15(26)12(25)6-29-20/h1-5,12,15,17,20-26,28H,6H2/t12-,15+,17-,20?/m1/s1
InChI Key PZZRDJXEMZMZFD-DUYPVGENSA-N
Canonical SMILES C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O
CAS 549326
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Other Names Quercetin-3-D-xyloside;
Reinutrin

In Other Databases

PubChem 5320863
ChemSpider 4478823