SMILES:
CCCCCCCCCCCCCCCCOCC(O)COC(c1ccccc1)(c1ccccc1)c1ccccc1Molecular Processing
Molecular formula
C38H54O3
Molecular weight
558.85
Exact mass
558.4073
XLogP
9.85
TPSA
38.69
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
23
Heavy atoms
41
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.526
Molar refractivity
172.3
Supplementary Information
Details werden geladen…
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