Glycoside
GD056265
Name:
NoneFormula:
C13H17O6N3SSmiles:
COc1nc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nc2ccsc12Aglycone:
COc1nc(N)nc2ccsc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -1.09 | Num_rotatable_bonds: | 4 |
| MolWt: | 343.36 | Num_heavy_atoms: | 23 |
| TPSA: | 137.19 | NumAromaticRings: | 2 |
Unique Aglycone
AD28311
Formula: C7H7ON3S
Smiles:
COc1nc(N)nc2ccsc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 1.28 | Num_rotatable_bonds: | 1 |
| MolWt: | 181.22 | Num_heavy_atoms: | 12 |
| TPSA: | 61.03 | NumAromaticRings: | 2 |
