Glycoside
GD083907
Name:
NoneFormula:
C18H22O8N4Smiles:
COC(=O)c1ccc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1OCAglycone:
COC(=O)c1ccc(NC2=C(C(N)=O)N=C[N]2)cc1OCSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.39 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 7 |
| MolWt: | 422.39 | Num_heavy_atoms: | 30 |
| TPSA: | 178.39 | NumAromaticRings: | 2 |
Unique Aglycone
AD37417
Formula: C13H13O4N4
Smiles:
COC(=O)c1ccc(NC2=C(C(N)=O)N=C[N]2)cc1OC| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.15 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 289.27 | Num_heavy_atoms: | 21 |
| TPSA: | 117.11 | NumAromaticRings: | 1 |
