COc1cc(C2CCC(OCCCN3C(=O)c4ccccc4C3=O)O2)cc(OC)c1OC
SMILES: COc1cc(C2CCC(OCCCN3C(=O)c4ccccc4C3=O)O2)cc(OC)c1OC

Molecular Processing

Molecular formula
C24H27NO7
Molecular weight
441.48
Exact mass
441.1788
XLogP
3.59
TPSA
83.53
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
32
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
115.32

Supplementary Information

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