CCC(=O)OCC1OC(Oc2nn(CC3CC3)c(C)c2Cc2ccc(OC(C)C)cc2)C(O)C(O)C1O
SMILES: CCC(=O)OCC1OC(Oc2nn(CC3CC3)c(C)c2Cc2ccc(OC(C)C)cc2)C(O)C(O)C1O

Molecular Processing

Molecular formula
C27H38N2O8
Molecular weight
518.61
Exact mass
518.2628
XLogP
2.12
TPSA
132.5
H-bond donors
3
H-bond acceptors
9
Rotatable bonds
11
Heavy atoms
37
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.63
Molar refractivity
133.26

Supplementary Information

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