Laricitrin 7-monoglucoside structure

Laricitrin 7-monoglucoside

2-(3,4-dihydroxy-5-methoxyphenyl)-3,5-dihydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one

Also Known As: Laricitrin 7-monoglucoside|Myricetin-3'-methyl ether-7-O-beta-D-glucopyranoside|2-(3,4-dihydroxy-5-methoxyphenyl)-3,5-dihydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one|4H-1-Benzopyran-4-one, 2-(3,4-dihydroxy-5-methoxyphenyl)-7-(beta-D-glucopyranosyloxy)-3,5-dihydroxy-|2-(3,4-Dihydroxy-5-methoxyphenyl)-3,5-dihydroxy-4-oxo-4H-1-benzopyran-7-yl beta-D-glucopyranoside|2-(3,4-dihydroxy-5-methoxyphenyl)-3,5-dihydroxy-7-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxychromen-4-one

CAS: 89345-45-9
Molecular Formula C22H22O13
Molecular Weight 494.10605 g/mol
LogP -0.5303
Topological Polar Surface Area 219.74 Ų
Hydrogen Bond Donors 8
Hydrogen Bond Acceptors 13
Rotatable Bonds 5
Exact Mass 494.10605
Monoisotopic Mass 494.10605
Heavy Atoms 35
Complexity 1315.1735

Chemical Identifiers

CAS Number 89345-45-9
SMILES COC1=CC(=CC(=C1O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O

Product Overview

Laricitrin 7-monoglucoside (CAS 89345-45-9), with molecular formula C22H22O13 and molecular weight 494.10605 g/mol. IUPAC: 2-(3,4-dihydroxy-5-methoxyphenyl)-3,5-dihydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one.

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