SMILES:
CCC(CC)(c1ccc(OCC(O)C(C)(C)C)c(C)c1)c1ccc(C(=O)O)c(C)c1Molecular Processing
Molecular formula
C26H36O4
Molecular weight
412.57
Exact mass
412.2614
XLogP
5.89
TPSA
66.76
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
30
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
121.64
Supplementary Information
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