Glycoside
GD077093
Name:
NoneFormula:
C17H22O6N4Smiles:
COc1cc(C)cc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Aglycone:
COc1cc(C)cc(NC2=C(C(N)=O)N=C[N]2)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.41 |
| AlogP: | -0.35 | Num_rotatable_bonds: | 6 |
| MolWt: | 378.39 | Num_heavy_atoms: | 27 |
| TPSA: | 152.09 | NumAromaticRings: | 2 |
Unique Aglycone
AD35408
Formula: C12H13O2N4
Smiles:
COc1cc(C)cc(NC2=C(C(N)=O)N=C[N]2)c1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.17 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 245.26 | Num_heavy_atoms: | 18 |
| TPSA: | 90.81 | NumAromaticRings: | 1 |
