CC(C#CC1=C(C)C(=O)C(C(=O)COc2ccccc2)C1(C)C)=CCO
SMILES: CC(C#CC1=C(C)C(=O)C(C(=O)COc2ccccc2)C1(C)C)=CCO

Molecular Processing

Molecular formula
C22H24O4
Molecular weight
352.43
Exact mass
352.1675
XLogP
3.12
TPSA
63.6
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
26
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
100.54

Supplementary Information

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