SMILES:
CCCC(=O)C1=C(O)CC(c2c(C)c(C)c(C)c3c2OC(C)C3C)CC1=OMolecular Processing
Molecular formula
C23H30O4
Molecular weight
370.49
Exact mass
370.2144
XLogP
5.12
TPSA
63.6
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
27
Rings
3
Aromatic rings
1
Saturated rings
0
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.565
Molar refractivity
105.71
Supplementary Information
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