Glycoside
GD043613
Name:
NoneFormula:
C11H12O4N6Smiles:
OC[C@@H]1O[C@@H](n2ccc3c2ncn2nnnc32)[C@@H](O)[C@@H]1OAglycone:
C1=Cc2c(ncn3nnnc23)[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | -1.91 | Num_rotatable_bonds: | 2 |
| MolWt: | 292.25 | Num_heavy_atoms: | 21 |
| TPSA: | 130.82 | NumAromaticRings: | 3 |
Unique Aglycone
AD24946
Formula: C6H3N6
Smiles:
C1=Cc2c(ncn3nnnc23)[N]1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 0 |
| MolWt: | 159.13 | Num_heavy_atoms: | 12 |
| TPSA: | 70.07 | NumAromaticRings: | 2 |
