Glycoside
GD052185
Name:
NoneFormula:
C13H16O4N4SSmiles:
C=CCSc1ncnc2c([C@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O)[nH]nc12Aglycone:
C=CCSc1ncnc2c[nH]nc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | -0.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 324.36 | Num_heavy_atoms: | 22 |
| TPSA: | 124.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD27095
Formula: C8H8N4S
Smiles:
C=CCSc1ncnc2c[nH]nc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.12 |
| AlogP: | 1.63 | Num_rotatable_bonds: | 3 |
| MolWt: | 192.25 | Num_heavy_atoms: | 13 |
| TPSA: | 54.46 | NumAromaticRings: | 2 |
