Glycoside
GD065613
Name:
NoneFormula:
C12H16O7N6Smiles:
Cn1nnc2c(C(=O)N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)ncn2c1=OAglycone:
Cn1nnc2c(C(N)=O)ncn2c1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -4.65 | Num_rotatable_bonds: | 3 |
| MolWt: | 356.3 | Num_heavy_atoms: | 25 |
| TPSA: | 184.33 | NumAromaticRings: | 2 |
Unique Aglycone
AD31562
Formula: C6H6O2N6
Smiles:
Cn1nnc2c(C(N)=O)ncn2c1=O| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | -2.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 194.15 | Num_heavy_atoms: | 14 |
| TPSA: | 108.17 | NumAromaticRings: | 2 |
