Name: 3-(4-Ethylbenzyl)-5-(2,3,4,6-tetra-O-benzyl-β-D-glucopyranosyl)-1H-indole
SMILES:
CCc1ccc(Cc2c[nH]c3ccc([C@@H]4O[C@H](COCc5ccccc5)[C@@H](OCc5ccccc5)[C@H](OCc5ccccc5)[C@H]4OCc4ccccc4)cc23)cc1Molecular Processing
Molecular formula
C51H51NO5
Molecular weight
757.97
Exact mass
757.3767
XLogP
10.73
TPSA
61.94
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
17
Heavy atoms
57
Rings
8
Aromatic rings
7
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.255
Molar refractivity
225.69
Supplementary Information
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