Glycoside
GD054373
Name:
NoneFormula:
C13H21O6N3SSmiles:
COCc1cc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nc(SC)n1Aglycone:
COCc1cc(N)nc(SC)n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -1.44 | Num_rotatable_bonds: | 6 |
| MolWt: | 347.39 | Num_heavy_atoms: | 23 |
| TPSA: | 137.19 | NumAromaticRings: | 1 |
Unique Aglycone
AD27722
Formula: C7H11ON3S
Smiles:
COCc1cc(N)nc(SC)n1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 0.93 | Num_rotatable_bonds: | 3 |
| MolWt: | 185.25 | Num_heavy_atoms: | 12 |
| TPSA: | 61.03 | NumAromaticRings: | 1 |
