Glycoside
GD047500
Name:
NoneFormula:
C13H19O5N4Smiles:
Cn1ccc2c[nH+]c(N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)nc21Aglycone:
Cn1ccc2c[nH+]c(N)nc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.54 |
| AlogP: | -2.4 | Num_rotatable_bonds: | 3 |
| MolWt: | 311.32 | Num_heavy_atoms: | 22 |
| TPSA: | 134.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD25532
Formula: C7H9N4
Smiles:
Cn1ccc2c[nH+]c(N)nc21| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.14 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 149.18 | Num_heavy_atoms: | 11 |
| TPSA: | 57.98 | NumAromaticRings: | 2 |
