CCCCCCCCCCCCCCCCCCc1cc2nc3ccc(O[C@@H]4O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]4OC(C)=O)cc3oc-2cc1=O
SMILES: CCCCCCCCCCCCCCCCCCc1cc2nc3ccc(O[C@@H]4O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]4OC(C)=O)cc3oc-2cc1=O

Molecular Processing

Molecular formula
C44H61NO12
Molecular weight
795.97
Exact mass
795.4194
XLogP
8.56
TPSA
166.76
H-bond donors
0
H-bond acceptors
13
Rotatable bonds
24
Heavy atoms
57
Rings
4
Aromatic rings
1
Saturated rings
1
Aliphatic rings
3
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.636
Molar refractivity
212.73

Supplementary Information

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