CC(=O)NC1C(OCc2ccccc2)OC(COCc2ccccc2)C(OS(C)(=O)=O)C1OCc1ccccc1
SMILES: CC(=O)NC1C(OCc2ccccc2)OC(COCc2ccccc2)C(OS(C)(=O)=O)C1OCc1ccccc1

Molecular Processing

Molecular formula
C30H35NO8S
Molecular weight
569.68
Exact mass
569.2083
XLogP
3.58
TPSA
109.39
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
13
Heavy atoms
40
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.367
Molar refractivity
148.33

Supplementary Information

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