Glycoside
GD006231
Name:
NoneFormula:
C16H20O5N8Smiles:
CCNC(=O)c1cnn(-c2nc(N)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1Aglycone:
CCNC(=O)c1cnn(-c2nc(N)c3c(n2)[N]C=N3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.44 |
| AlogP: | -2.04 | Num_rotatable_bonds: | 5 |
| MolWt: | 404.39 | Num_heavy_atoms: | 29 |
| TPSA: | 186.46 | NumAromaticRings: | 3 |
Unique Aglycone
AD05173
Formula: C11H11ON8
Smiles:
CCNC(=O)c1cnn(-c2nc(N)c3c(n2)[N]C=N3)c1| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.18 |
| AlogP: | -0.1 | Num_rotatable_bonds: | 3 |
| MolWt: | 271.26 | Num_heavy_atoms: | 20 |
| TPSA: | 125.18 | NumAromaticRings: | 2 |
