이름: (2R,3R,4R,5S,6S)-3,4,5-tris(benzyloxy)-2-(benzyloxymethyl)-6-(3-(bromomethyl)-4-chlorophenyl)-tetrahydro-2H-pyran
SMILES:
Clc1ccc([C@@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)cc1CBrMolecular Processing
Molecular formula
C41H40BrClO5
Molecular weight
728.12
Exact mass
726.1748
XLogP
9.65
TPSA
46.15
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
15
Heavy atoms
48
Rings
6
Aromatic rings
5
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.268
Molar refractivity
192.85
Supplementary Information
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