CCC(O)(CC)C1CC(C(CC2CCCCC2)NC(=O)OC(C)(C)C)OC1=O
SMILES: CCC(O)(CC)C1CC(C(CC2CCCCC2)NC(=O)OC(C)(C)C)OC1=O

Molecular Processing

Molecular formula
C22H39NO5
Molecular weight
397.56
Exact mass
397.2828
XLogP
4.33
TPSA
84.86
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
28
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.909
Molar refractivity
107.87

Supplementary Information

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