Glycoside
GD078184
Name:
NoneFormula:
C20H22O5N4Smiles:
Cc1ccc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c2ccccc12Aglycone:
Cc1ccc(NC2=C(C(N)=O)N=C[N]2)c2ccccc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.3 |
| AlogP: | 0.8 | Num_rotatable_bonds: | 5 |
| MolWt: | 398.42 | Num_heavy_atoms: | 29 |
| TPSA: | 142.86 | NumAromaticRings: | 3 |
Unique Aglycone
AD35855
Formula: C15H13ON4
Smiles:
Cc1ccc(NC2=C(C(N)=O)N=C[N]2)c2ccccc12| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.07 |
| AlogP: | 1.86 | Num_rotatable_bonds: | 3 |
| MolWt: | 265.3 | Num_heavy_atoms: | 20 |
| TPSA: | 81.58 | NumAromaticRings: | 2 |
