Glycoside
GD056603
Name:
NoneFormula:
C13H19O5N3SSmiles:
OC[C@H]1O[C@H](O)[C@H](Nc2ncnc3c2SCCC3)[C@@H](O)[C@@H]1OAglycone:
Nc1ncnc2c1SCCC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -1.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 329.38 | Num_heavy_atoms: | 22 |
| TPSA: | 127.96 | NumAromaticRings: | 1 |
Unique Aglycone
AD28447
Formula: C7H9N3S
Smiles:
Nc1ncnc2c1SCCC2| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 0 |
| MolWt: | 167.24 | Num_heavy_atoms: | 11 |
| TPSA: | 51.8 | NumAromaticRings: | 1 |
