Glycoside
GD039989
Name:
6-s-(prop-2-yn-1-yl)-6-thio-beta-d-glucopyranosyl 1-thio-beta-d-galactopyranosideFormula:
C15H24O9S2Smiles:
C#CCSC[C@H]1O[C@H](S[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@@H]1OAglycone:
C#CCSCSugarmoiety:
OCC1OC(SC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.87 |
| AlogP: | -3.31 | Num_rotatable_bonds: | 6 |
| MolWt: | 412.48 | Num_heavy_atoms: | 26 |
| TPSA: | 160.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD08097
Formula: C4H6S
Smiles:
C#CCSC| HBA: | 0 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.5 |
| AlogP: | 0.98 | Num_rotatable_bonds: | 1 |
| MolWt: | 86.16 | Num_heavy_atoms: | 5 |
| TPSA: | 0.0 | NumAromaticRings: | 0 |
