CC(=O)[C@@]1(O)C[C@@H](O)[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)[C@H]3CC[C@@]21C
SMILES: CC(=O)[C@@]1(O)C[C@@H](O)[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)[C@H]3CC[C@@]21C

Molecular Processing

Molecular formula
C22H27ClO4
Molecular weight
390.91
Exact mass
390.1598
XLogP
3.01
TPSA
74.6
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
27
Rings
5
Aromatic rings
0
Saturated rings
3
Aliphatic rings
5
Stereo centers
9
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.727
Molar refractivity
100.8

Supplementary Information

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