Name: Tert-butyl[(1S,5R,6R)-6-(tert-butoxycarbonylamino)methyl-3-methylbicyclo[3.2.0]hept-3-en-6-yl]acetate
SMILES:
CC1=C[C@H]2[C@@H](C1)C[C@@]2(CNC(=O)OC(C)(C)C)CC(=O)OC(C)(C)CMolecular Processing
Molecular formula
C20H33NO4
Molecular weight
351.49
Exact mass
351.241
XLogP
4.22
TPSA
64.63
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
25
Rings
2
Aromatic rings
0
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
97.1
Supplementary Information
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