SMILES:
CC(=O)[O-].C[C@]12CC[C@@H]3c4ccc(O)cc4CC[C@H]3[C@@H]1CCC2=OMolecular Processing
Molecular formula
C20H25O4-
Molecular weight
329.42
Exact mass
329.1758
XLogP
2.57
TPSA
77.43
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
24
Rings
4
Aromatic rings
1
Saturated rings
2
Aliphatic rings
3
Stereo centers
4
Undefined stereo
0
Formal charge
-1
Heteroatoms
4
Covalent units
2
Fraction Csp3
0.6
Molar refractivity
88.41
Supplementary Information
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