C[C@]12CC[C@H]3[C@@H](CC(=O)[C@@]4(O)CC(=O)CC[C@]34C)[C@@H]1CCC2=O
SMILES: C[C@]12CC[C@H]3[C@@H](CC(=O)[C@@]4(O)CC(=O)CC[C@]34C)[C@@H]1CCC2=O

Molecular Processing

Molecular formula
C19H26O4
Molecular weight
318.41
Exact mass
318.1831
XLogP
2.46
TPSA
71.44
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
23
Rings
4
Aromatic rings
0
Saturated rings
4
Aliphatic rings
4
Stereo centers
6
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.842
Molar refractivity
83.59

Supplementary Information

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