Glycoside
GD091489
Name:
NoneFormula:
C19H26O6N6Smiles:
CCN(CC)C(=O)c1ccc(Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cn1Aglycone:
CCN(CC)C(=O)c1ccc(NC2=C(C(N)=O)N=C[N]2)cn1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.47 |
| AlogP: | -0.79 | Num_rotatable_bonds: | 8 |
| MolWt: | 434.45 | Num_heavy_atoms: | 31 |
| TPSA: | 176.06 | NumAromaticRings: | 2 |
Unique Aglycone
AD39926
Formula: C14H17O2N6
Smiles:
CCN(CC)C(=O)c1ccc(NC2=C(C(N)=O)N=C[N]2)cn1| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 0.28 | Num_rotatable_bonds: | 6 |
| MolWt: | 301.33 | Num_heavy_atoms: | 22 |
| TPSA: | 114.78 | NumAromaticRings: | 1 |
