CCc1ccc(Cc2ccc(NC(=O)OCc3ccccc3)cc2OC2OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)cc1
SMILES: CCc1ccc(Cc2ccc(NC(=O)OCc3ccccc3)cc2OC2OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C2OC(C)=O)cc1

Molecular Processing

Molecular formula
C37H41NO12
Molecular weight
691.73
Exact mass
691.2629
XLogP
5.05
TPSA
161.99
H-bond donors
1
H-bond acceptors
12
Rotatable bonds
13
Heavy atoms
50
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.378
Molar refractivity
177.9

Supplementary Information

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