Glycoside
GD045527
Name:
NoneFormula:
C12H17O4N4Smiles:
CNc1[nH+]cnc2c1ccn2[C@H]1O[C@@H](CO)[C@@H](O)[C@@H]1OAglycone:
CNc1[nH+]cnc2c1C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.5 | Num_rotatable_bonds: | 3 |
| MolWt: | 281.29 | Num_heavy_atoms: | 20 |
| TPSA: | 113.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD25265
Formula: C7H8N4
Smiles:
CNc1[nH+]cnc2c1C=C[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 0.16 | Num_rotatable_bonds: | 1 |
| MolWt: | 148.17 | Num_heavy_atoms: | 11 |
| TPSA: | 53.16 | NumAromaticRings: | 1 |
