Name: (7S)-7-Benzyloxycarbonylamino-octanedioic acid 8-tert-butyl ester
SMILES:
CC(C)(C)OC(=O)[C@H](CCCCCC(=O)O)NC(=O)OCc1ccccc1Molecular Processing
Molecular formula
C20H29NO6
Molecular weight
379.45
Exact mass
379.1995
XLogP
3.66
TPSA
101.93
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
27
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.55
Molar refractivity
100.12
Supplementary Information
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