Glycoside
GD005503
Name:
NoneFormula:
C13H18O5N4Smiles:
COCCc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
COCCc1ncnc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.62 |
| AlogP: | -1.37 | Num_rotatable_bonds: | 5 |
| MolWt: | 310.31 | Num_heavy_atoms: | 22 |
| TPSA: | 122.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD04673
Formula: C8H9ON4
Smiles:
COCCc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.38 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 177.19 | Num_heavy_atoms: | 13 |
| TPSA: | 61.47 | NumAromaticRings: | 1 |
