Glycoside
GD009248
Name:
NoneFormula:
C18H22O5N6Smiles:
Nc1nc(NCC(O)c2ccccc2)c2ncn(C3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
Nc1nc2c(c(NCC(O)c3ccccc3)n1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.39 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 6 |
| MolWt: | 402.41 | Num_heavy_atoms: | 29 |
| TPSA: | 171.8 | NumAromaticRings: | 3 |
Unique Aglycone
AD07271
Formula: C13H13ON6
Smiles:
Nc1nc2c(c(NCC(O)c3ccccc3)n1)N=C[N]2| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.15 |
| AlogP: | 1.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 269.29 | Num_heavy_atoms: | 20 |
| TPSA: | 110.52 | NumAromaticRings: | 2 |
