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84274-52-2 | Gallic acid 4-O-beta-D-glucopyranoside, Min.
CAS No: 84274-52-2 Catalog No: AG01FH2G MDL No:
Product Description
Catalog Number:
AG01FH2G
Chemical Name:
Gallic acid 4-O-beta-D-glucopyranoside, Min.
CAS Number:
84274-52-2
IUPAC Name:
3,5-dihydroxy-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoic acid
InChI:
InChI=1S/C13H16O10/c14-3-7-8(17)9(18)10(19)13(22-7)23-11-5(15)1-4(12(20)21)2-6(11)16/h1-2,7-10,13-19H,3H2,(H,20,21)/t7-,8-,9+,10-,13+/m1/s1
InChI Key:
YPSNWSNUXIIKHO-YANYRWCTSA-N
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
332.074g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
7
Isotope Atom Count:
0
Molecular Weight:
332.261g/mol
Monoisotopic Mass:
332.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
177A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.7
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