SMILES:
CC(CCCC(C)C1CCC2C3CCC4CCCCC4(C)C3CCC12C)COC1OC(CO)C(OCc2ccccc2)C(O)C1OCc1ccccc1Molecular Processing
Molecular formula
C47H70O6
Molecular weight
731.07
Exact mass
730.5172
XLogP
9.74
TPSA
77.38
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
15
Heavy atoms
53
Rings
7
Aromatic rings
2
Saturated rings
5
Aliphatic rings
5
Stereo centers
14
Undefined stereo
14
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.745
Molar refractivity
209.76
Supplementary Information
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