SMILES:
CCC(=O)C(CCC(=CCCc1ccc2c(c1)OCO2)CC)C(=O)CCMolecular Processing
Molecular formula
C22H30O4
Molecular weight
358.48
Exact mass
358.2144
XLogP
5.04
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
11
Heavy atoms
26
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.545
Molar refractivity
102.58
Supplementary Information
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