Name: ( 1 )
SMILES:
COC(=O)C(CN1C(=O)C2=C(CCCC2)C1=O)C1(C)OCCO1Molecular Processing
Molecular formula
C16H21NO6
Molecular weight
323.35
Exact mass
323.1369
XLogP
0.78
TPSA
82.14
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
23
Rings
3
Aromatic rings
0
Saturated rings
1
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.688
Molar refractivity
78.03
Supplementary Information
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