Glycoside
GD023789
Name:
NoneFormula:
C17H22O5N8Smiles:
CCNC(=O)Cn1cc(-c2nc(N)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)cn1Aglycone:
CCNC(=O)Cn1cc(-c2nc(N)c3c(n2)[N]C=N3)cn1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.47 |
| AlogP: | -1.98 | Num_rotatable_bonds: | 6 |
| MolWt: | 418.41 | Num_heavy_atoms: | 30 |
| TPSA: | 186.46 | NumAromaticRings: | 3 |
Unique Aglycone
AD15968
Formula: C12H13ON8
Smiles:
CCNC(=O)Cn1cc(-c2nc(N)c3c(n2)[N]C=N3)cn1| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 4 |
| MolWt: | 285.29 | Num_heavy_atoms: | 21 |
| TPSA: | 125.18 | NumAromaticRings: | 2 |
