SMILES:
O=C(O)CCCCC1CCSS1.OC[C@H]1O[C@@H]2O[C@H]3[C@H](O)[C@@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@@H](O[C@H]5[C@H](O)[C@@H](O)[C@@H](O[C@H]6[C@H](O)[C@@H](O)[C@@H](O[C@H]7[C@H](O)[C@@H](O)[C@@H](O[C@H]1[C@H](O)[C@H]2O)O[C@@H]7CO)O[C@@H]6CO)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3COMolecular Processing
Molecular formula
C44H74O32S2
Molecular weight
1179.18
Exact mass
1178.3605
XLogP
-10.27
TPSA
512.2
H-bond donors
19
H-bond acceptors
33
Rotatable bonds
11
Heavy atoms
78
Rings
23
Aromatic rings
0
Saturated rings
23
Aliphatic rings
23
Stereo centers
31
Undefined stereo
1
Formal charge
0
Heteroatoms
34
Covalent units
2
Fraction Csp3
0.977
Molar refractivity
250.36
Supplementary Information
Obteniendo detalles…
Participa en 8 reacciones→