SMILES:
COc1ccc(C2CCC(OC(C)=O)CC2NC(=O)c2ccc(OCC3CC3)c(OCC3CC3)c2)cc1OCMolecular Processing
Molecular formula
C31H39NO7
Molecular weight
537.65
Exact mass
537.2727
XLogP
5.28
TPSA
92.32
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
12
Heavy atoms
39
Rings
5
Aromatic rings
2
Saturated rings
3
Aliphatic rings
3
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.548
Molar refractivity
145.83
Supplementary Information
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Involved in 5 reactions→