Glycoside
GD023533
Name:
NoneFormula:
C10H12O7N4Smiles:
O=c1[nH]c(=O)c2nc(O)n(C3O[C@H](CO)[C@H](O)[C@H]3O)c2[nH]1Aglycone:
O=c1[nH]c2c(c(=O)[nH]1)N=C(O)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -3.27 | Num_rotatable_bonds: | 2 |
| MolWt: | 300.23 | Num_heavy_atoms: | 21 |
| TPSA: | 173.69 | NumAromaticRings: | 2 |
Unique Aglycone
AD15815
Formula: C5H3O3N4
Smiles:
O=c1[nH]c2c(c(=O)[nH]1)N=C(O)[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -1.14 | Num_rotatable_bonds: | 0 |
| MolWt: | 167.1 | Num_heavy_atoms: | 12 |
| TPSA: | 112.41 | NumAromaticRings: | 1 |
