SMILES:
COc1ccccc1COCCCOc1ccc(C2CCN(C(=O)OC(C)(C)C)CC2O)cc1Molecular Processing
Molecular formula
C27H37NO6
Molecular weight
471.59
Exact mass
471.2621
XLogP
4.77
TPSA
77.46
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
34
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.519
Molar refractivity
130.38
Supplementary Information
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