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210297-56-6 | α-D-Mannopyranoside, methyl 3,4-bis-O-(phenylmethyl)-2-O-2-propen-1-yl-
CAS No: 210297-56-6 Catalog No: AG002KOF MDL No:
Product Description
Catalog Number:
AG002KOF
Chemical Name:
α-D-Mannopyranoside, methyl 3,4-bis-O-(phenylmethyl)-2-O-2-propen-1-yl-
CAS Number:
210297-56-6
Molecular Formula:
C24H30O6
Molecular Weight:
414.4914
IUPAC Name:
[(2R,3R,4S,5S,6S)-6-methoxy-3,4-bis(phenylmethoxy)-5-prop-2-enoxyoxan-2-yl]methanol
InChI:
InChI=1S/C24H30O6/c1-3-14-27-23-22(29-17-19-12-8-5-9-13-19)21(20(15-25)30-24(23)26-2)28-16-18-10-6-4-7-11-18/h3-13,20-25H,1,14-17H2,2H3/t20-,21-,22+,23+,24+/m1/s1
InChI Key:
GBXPCZLNEKGTHT-DJCPXJLLSA-N
SMILES:
C=CCO[C@@H]1[C@@H](OC)O[C@@H]([C@H]([C@@H]1OCc1ccccc1)OCc1ccccc1)CO
Properties
Complexity:
474
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
5
Defined Bond Stereocenter Count:
0
Exact Mass:
414.204g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
414.498g/mol
Monoisotopic Mass:
414.204g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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