Glycoside
GD050984
Name:
NoneFormula:
C15H19O5N3Smiles:
N#Cc1cc2c(nc1N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)CCC2Aglycone:
N#Cc1cc2c(nc1N)CCC2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | -1.35 | Num_rotatable_bonds: | 3 |
| MolWt: | 321.33 | Num_heavy_atoms: | 23 |
| TPSA: | 138.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD26800
Formula: C9H9N3
Smiles:
N#Cc1cc2c(nc1N)CCC2| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 0 |
| MolWt: | 159.19 | Num_heavy_atoms: | 12 |
| TPSA: | 62.7 | NumAromaticRings: | 1 |
