Glycoside
GD004555
Name:
NoneFormula:
C10H11O7N5Smiles:
O=Nn1c(=O)c2c(O)ncnc2n1C1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
O=NN1[N]c2ncnc(O)c2C1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -2.56 | Num_rotatable_bonds: | 3 |
| MolWt: | 313.23 | Num_heavy_atoms: | 22 |
| TPSA: | 172.29 | NumAromaticRings: | 2 |
Unique Aglycone
AD03960
Formula: C5H2O3N5
Smiles:
O=NN1[N]c2ncnc(O)c2C1=O| HBA: | 8 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | -0.53 | Num_rotatable_bonds: | 1 |
| MolWt: | 180.1 | Num_heavy_atoms: | 13 |
| TPSA: | 109.85 | NumAromaticRings: | 1 |
