Glycoside
GD000211
Name:
NoneFormula:
C9H13O5N3Smiles:
O=CNc1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)cn1Aglycone:
O=CNC1=C[N]C=N1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -1.94 | Num_rotatable_bonds: | 4 |
| MolWt: | 243.22 | Num_heavy_atoms: | 17 |
| TPSA: | 116.84 | NumAromaticRings: | 1 |
Unique Aglycone
AD00245
Formula: C4H4ON3
Smiles:
O=CNC1=C[N]C=N1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 2 |
| MolWt: | 110.1 | Num_heavy_atoms: | 8 |
| TPSA: | 55.56 | NumAromaticRings: | 0 |
