Glycoside
...
GD040179

Name:
thiocellobiose

Formula:
C12H22O10S

Smiles:
OC[C@H]1O[C@@H](O)[C@@H](O)[C@@H](O)[C@@H]1S[C@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]1O

Aglycone:
[empty]

Sugarmoiety:
OCC1OC(SC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 10 RingCount: 2
HBD: 8 FractionCSP3: 1.0
AlogP: -4.68 Num_rotatable_bonds: 4
MolWt: 358.37 Num_heavy_atoms: 23
TPSA: 180.3 NumAromaticRings: 0

Unique Aglycone

Sugarmoiety
SD03557

OCC1OC(SC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O