SMILES:
Cc1c(C)c2c(c(C)c1OCc1ccccc1)CCC(C)(CC(=O)O)O2Molecular Processing
Molecular formula
C22H26O4
Molecular weight
354.45
Exact mass
354.1831
XLogP
4.75
TPSA
55.76
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.409
Molar refractivity
101.03
Supplementary Information
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