SMILES:
CCCCCC(CCCC(CCCc1ccc(C(=O)OCC)cc1)C(C)=O)OC(C)=OMolecular Processing
Molecular formula
C26H40O5
Molecular weight
432.6
Exact mass
432.2876
XLogP
6.07
TPSA
69.67
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
16
Heavy atoms
31
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.654
Molar refractivity
123.05
Supplementary Information
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