SMILES:
C=CCOC1CCC2(C)C(CCC3C2CCC2(C)C(c4ccoc4)CCC32O)C1Molecular Processing
Molecular formula
C26H38O3
Molecular weight
398.59
Exact mass
398.2821
XLogP
6.09
TPSA
42.6
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
29
Rings
5
Aromatic rings
1
Saturated rings
4
Aliphatic rings
4
Stereo centers
8
Undefined stereo
8
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.769
Molar refractivity
114.57
Supplementary Information
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