Glycoside
GD001434
Name:
NoneFormula:
C19H24O5N8Smiles:
NC(=O)c1cnn(-c2nc(NC3CCCC3)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1Aglycone:
NC(=O)c1cnn(-c2nc3c(c(NC4CCCC4)n2)N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.53 |
| AlogP: | -0.92 | Num_rotatable_bonds: | 6 |
| MolWt: | 444.45 | Num_heavy_atoms: | 32 |
| TPSA: | 186.46 | NumAromaticRings: | 3 |
Unique Aglycone
AD01443
Formula: C14H15ON8
Smiles:
NC(=O)c1cnn(-c2nc3c(c(NC4CCCC4)n2)N=C[N]3)c1| HBA: | 9 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 4 |
| MolWt: | 311.33 | Num_heavy_atoms: | 23 |
| TPSA: | 125.18 | NumAromaticRings: | 2 |
