SMILES:
CCN(C=C1C(=O)OC(COC)C2(C)C1=C(O)C(=O)C1=C2C(OC(C)=O)CC2(C)C(O)CCC12)CCN(C)CMolecular Processing
Molecular formula
C29H42N2O8
Molecular weight
546.66
Exact mass
546.2941
XLogP
2.14
TPSA
125.84
H-bond donors
2
H-bond acceptors
10
Rotatable bonds
8
Heavy atoms
39
Rings
4
Aromatic rings
0
Saturated rings
2
Aliphatic rings
4
Stereo centers
6
Undefined stereo
6
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.69
Molar refractivity
142.44
Supplementary Information
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