الاسم: (2S,3R,4R,5S,6R)-2-[3-(4-benzyl-3,4-dihydro-2H-benzo[1,4]oxazin-6-ylmethyl)-4-chloro-phenyl]-6-hydroxymethyl-tetrahydro-pyran-3,4,5-triol
SMILES:
OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc4c(c3)N(Cc3ccccc3)CCO4)c2)[C@H](O)[C@@H](O)[C@@H]1OMolecular Processing
Molecular formula
C28H30ClNO6
Molecular weight
512
Exact mass
511.1762
XLogP
2.84
TPSA
102.62
H-bond donors
4
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
36
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.357
Molar refractivity
136.41
Supplementary Information
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