CCOC(=O)c1cc2ccc(C(CC)(CC)c3ccc(OCC(=O)C(C)(C)C)c(C)c3)cc2o1
SMILES: CCOC(=O)c1cc2ccc(C(CC)(CC)c3ccc(OCC(=O)C(C)(C)C)c(C)c3)cc2o1

Molecular Processing

Molecular formula
C29H36O5
Molecular weight
464.6
Exact mass
464.2563
XLogP
7.02
TPSA
65.74
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
9
Heavy atoms
34
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.448
Molar refractivity
134.67

Supplementary Information

Details werden geladen…

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