Glycoside
GD045039
Name:
NoneFormula:
C12H15O5N3Smiles:
N#Cc1ccnc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1Aglycone:
N#Cc1ccnc(N)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.83 | Num_rotatable_bonds: | 3 |
| MolWt: | 281.27 | Num_heavy_atoms: | 20 |
| TPSA: | 138.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD25135
Formula: C6H5N3
Smiles:
N#Cc1ccnc(N)c1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 0 |
| MolWt: | 119.13 | Num_heavy_atoms: | 9 |
| TPSA: | 62.7 | NumAromaticRings: | 1 |
