Glycoside
GD044487
Name:
NoneFormula:
C12H20O5N3Smiles:
Cc1cc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nc(C)[nH+]1Aglycone:
Cc1cc(N)nc(C)[nH+]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.67 |
| AlogP: | -2.28 | Num_rotatable_bonds: | 3 |
| MolWt: | 286.31 | Num_heavy_atoms: | 20 |
| TPSA: | 129.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD25036
Formula: C6H10N3
Smiles:
Cc1cc(N)nc(C)[nH+]1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 0 |
| MolWt: | 124.17 | Num_heavy_atoms: | 9 |
| TPSA: | 53.05 | NumAromaticRings: | 1 |
