SMILES:
C=C(C)[C@@H]1CC[C@]2(NC(=O)NCC(C)(C)N3CCOCC3)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC=C(c6ccc(C(=O)O)cc6)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12Molecular Processing
Molecular formula
C45H67N3O4
Molecular weight
714.05
Exact mass
713.5132
XLogP
9.2
TPSA
90.9
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
52
Rings
7
Aromatic rings
1
Saturated rings
5
Aliphatic rings
6
Stereo centers
9
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.733
Molar refractivity
209.03
Supplementary Information
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