CCc1ccc(Cc2cc(C3(CO)OC(COCc4ccccc4)C(OCc4ccccc4)C(OCc4ccccc4)C3OCc3ccccc3)c(O)cc2Cl)cc1
SMILES: CCc1ccc(Cc2cc(C3(CO)OC(COCc4ccccc4)C(OCc4ccccc4)C(OCc4ccccc4)C3OCc3ccccc3)c(O)cc2Cl)cc1

Molecular Processing

Molecular formula
C50H51ClO7
Molecular weight
799.4
Exact mass
798.3323
XLogP
9.76
TPSA
86.61
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
18
Heavy atoms
58
Rings
7
Aromatic rings
6
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.28
Molar refractivity
226.53

Supplementary Information

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