CC(=O)OC1O[C@](COC(=O)c2ccccc2)([C@@H](CO)OC(=O)c2ccccc2)[C@H](OCc2ccccc2)[C@H]1OC(C)=O
Name: mixture 3
SMILES: CC(=O)OC1O[C@](COC(=O)c2ccccc2)([C@@H](CO)OC(=O)c2ccccc2)[C@H](OCc2ccccc2)[C@H]1OC(C)=O

Molecular Processing

Molecular formula
C32H32O11
Molecular weight
592.6
Exact mass
592.1945
XLogP
3.24
TPSA
143.89
H-bond donors
1
H-bond acceptors
11
Rotatable bonds
12
Heavy atoms
43
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
149.4

Supplementary Information

Details werden geladen…

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