SMILES:
CC(=O)Oc1cc2c(c(OC(C)=O)c1)C1CCC3(C)C(=O)CCC3C1CC2Molecular Processing
Molecular formula
C22H26O5
Molecular weight
370.45
Exact mass
370.178
XLogP
3.96
TPSA
69.67
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
27
Rings
4
Aromatic rings
1
Saturated rings
2
Aliphatic rings
3
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.591
Molar refractivity
98.68
Supplementary Information
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