Glycoside
GD105801
Name:
NoneFormula:
C11H23O13N6P3Smiles:
CO[C@@H]1[C@H](O)[C@H](CO[PH](O)(O)O[PH](O)(O)OP(=O)(O)O)O[C@H]1n1cnc2c(N)nc(N)nc21Aglycone:
CO[PH](O)(O)O[PH](O)(O)OP(=O)(O)O.Nc1nc(N)c2c(n1)[N]C=N2Sugarmoiety:
COC1C(O)OC(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 3 |
| HBD: | 11 | FractionCSP3: | 0.55 |
| AlogP: | -2.8 | Num_rotatable_bonds: | 9 |
| MolWt: | 540.26 | Num_heavy_atoms: | 33 |
| TPSA: | 300.47 | NumAromaticRings: | 2 |
Unique Aglycone
AD01628
Formula: C5H5N6
Smiles:
Nc1nc(N)c2c(n1)[N]C=N2| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | -0.45 | Num_rotatable_bonds: | 0 |
| MolWt: | 149.14 | Num_heavy_atoms: | 11 |
| TPSA: | 104.28 | NumAromaticRings: | 1 |
AD40402
Formula: CH11O10P3
Smiles:
CO[PH](O)(O)O[PH](O)(O)OP(=O)(O)O| HBA: | 10 | RingCount: | 0 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -1.45 | Num_rotatable_bonds: | 5 |
| MolWt: | 276.01 | Num_heavy_atoms: | 14 |
| TPSA: | 166.14 | NumAromaticRings: | 0 |
