Glycoside
GD049369
Name:
NoneFormula:
C12H15O5N5Smiles:
OC[C@H]1O[C@H](O)[C@H](n2cc(-c3cnccn3)nn2)[C@@H](O)[C@@H]1OAglycone:
C1=C(c2cnccn2)N=N[N]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -2.29 | Num_rotatable_bonds: | 3 |
| MolWt: | 309.28 | Num_heavy_atoms: | 22 |
| TPSA: | 146.64 | NumAromaticRings: | 2 |
Unique Aglycone
AD26138
Formula: C6H4N5
Smiles:
C1=C(c2cnccn2)N=N[N]1| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 0.76 | Num_rotatable_bonds: | 1 |
| MolWt: | 146.13 | Num_heavy_atoms: | 11 |
| TPSA: | 64.6 | NumAromaticRings: | 1 |
