Glycoside
GD084770
Name:
NoneFormula:
C19H22O5N6Smiles:
Cc1c(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cnn1-c1ccccc1Aglycone:
Cc1c(NC2=C(C(N)=O)N=C[N]2)cnn1-c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.32 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 6 |
| MolWt: | 414.42 | Num_heavy_atoms: | 30 |
| TPSA: | 160.68 | NumAromaticRings: | 3 |
Unique Aglycone
AD37911
Formula: C14H13ON6
Smiles:
Cc1c(NC2=C(C(N)=O)N=C[N]2)cnn1-c1ccccc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.07 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 4 |
| MolWt: | 281.3 | Num_heavy_atoms: | 21 |
| TPSA: | 99.4 | NumAromaticRings: | 2 |
