Glycoside
GD091253
Name:
NoneFormula:
C20H27O6N5Smiles:
Cc1cc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)ccc1N1CCOCC1Aglycone:
Cc1cc(NC2=C(C(N)=O)N=C[N]2)ccc1N1CCOCC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -0.52 | Num_rotatable_bonds: | 6 |
| MolWt: | 433.47 | Num_heavy_atoms: | 31 |
| TPSA: | 155.33 | NumAromaticRings: | 2 |
Unique Aglycone
AD39789
Formula: C15H18O2N5
Smiles:
Cc1cc(NC2=C(C(N)=O)N=C[N]2)ccc1N1CCOCC1| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 4 |
| MolWt: | 300.34 | Num_heavy_atoms: | 22 |
| TPSA: | 94.05 | NumAromaticRings: | 1 |
