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6032-32-2 | p-Methoxyphenyl b-D-glucoside
CAS No: 6032-32-2 Catalog No: AG003LOJ MDL No:MFCD06797143
Product Description
Catalog Number:
AG003LOJ
Chemical Name:
p-Methoxyphenyl b-D-glucoside
CAS Number:
6032-32-2
Molecular Formula:
C13H18O7
Molecular Weight:
286.2778
MDL Number:
MFCD06797143
IUPAC Name:
(2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-methoxyphenoxy)oxane-3,4,5-triol
InChI:
InChI=1S/C13H18O7/c1-18-7-2-4-8(5-3-7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10-,11+,12-,13-/m1/s1
InChI Key:
SIXFVXJMCGPTRB-UJPOAAIJSA-N
SMILES:
OC[C@H]1O[C@@H](Oc2ccc(cc2)OC)[C@@H]([C@H]([C@@H]1O)O)O
UNII:
F9MW5FU0XH
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
286.105g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
286.28g/mol
Monoisotopic Mass:
286.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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