SMILES:
CC1CCC2(OC1)OC1C=C3C4CCC5CC(=O)C(=N)CC5(C)C4CC(=O)C3(C)C1C2CMolecular Processing
Molecular formula
C27H37NO4
Molecular weight
439.6
Exact mass
439.2723
XLogP
4.73
TPSA
76.45
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
0
Heavy atoms
32
Rings
6
Aromatic rings
0
Saturated rings
5
Aliphatic rings
6
Stereo centers
10
Undefined stereo
10
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.815
Molar refractivity
120.2
Supplementary Information
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