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303127-80-2 | β-D-Glucopyranoside, 4-methoxyphenyl 3-O-(phenylmethyl)-
CAS No: 303127-80-2 Catalog No: AG002ZMO MDL No:
Product Description
Catalog Number:
AG002ZMO
Chemical Name:
β-D-Glucopyranoside, 4-methoxyphenyl 3-O-(phenylmethyl)-
CAS Number:
303127-80-2
Molecular Formula:
C20H24O7
Molecular Weight:
376.4004
IUPAC Name:
(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-(4-methoxyphenoxy)-4-phenylmethoxyoxane-3,5-diol
InChI:
InChI=1S/C20H24O7/c1-24-14-7-9-15(10-8-14)26-20-18(23)19(17(22)16(11-21)27-20)25-12-13-5-3-2-4-6-13/h2-10,16-23H,11-12H2,1H3/t16-,17-,18-,19+,20-/m1/s1
InChI Key:
CZPFTCBIXZWFIZ-LTFPLMDUSA-N
SMILES:
OC[C@H]1O[C@@H](Oc2ccc(cc2)OC)[C@@H]([C@H]([C@@H]1O)OCc1ccccc1)O
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
376.152g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
376.405g/mol
Monoisotopic Mass:
376.152g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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