SMILES:
COC1C(OC(=O)NC2CCCCC2)CCC2(CO2)C1C1(C)OC1CC=OMolecular Processing
Molecular formula
C20H31NO6
Molecular weight
381.47
Exact mass
381.2151
XLogP
2.35
TPSA
89.69
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
27
Rings
4
Aromatic rings
0
Saturated rings
4
Aliphatic rings
4
Stereo centers
6
Undefined stereo
6
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.9
Molar refractivity
96.44
Supplementary Information
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