Glycoside
GD046958
Name:
NoneFormula:
C11H18O7N4Smiles:
COc1nc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(N)c(=O)[nH]1Aglycone:
COc1nc(N)c(N)c(=O)[nH]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.64 |
| AlogP: | -3.43 | Num_rotatable_bonds: | 4 |
| MolWt: | 318.29 | Num_heavy_atoms: | 22 |
| TPSA: | 183.18 | NumAromaticRings: | 1 |
Unique Aglycone
AD14774
Formula: C5H8O2N4
Smiles:
COc1nc(N)c(N)c(=O)[nH]1| HBA: | 6 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.2 |
| AlogP: | -1.06 | Num_rotatable_bonds: | 1 |
| MolWt: | 156.15 | Num_heavy_atoms: | 11 |
| TPSA: | 107.02 | NumAromaticRings: | 1 |
