Glycoside
GD105833
Name:
NoneFormula:
C10H22O14N5P3Smiles:
N=C1NC(=O)[C@H]2N=CN([C@H]3O[C@H](CO[PH](O)(O)O[PH](O)(O)OP(=O)(O)O)[C@@H](O)[C@H]3O)[C@@H]2N1Aglycone:
CO[PH](O)(O)O[PH](O)(O)OP(=O)(O)O.N=C1NC(=O)C2N=CNC2N1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 3 |
| HBD: | 11 | FractionCSP3: | 0.7 |
| AlogP: | -4.94 | Num_rotatable_bonds: | 8 |
| MolWt: | 529.23 | Num_heavy_atoms: | 32 |
| TPSA: | 296.41 | NumAromaticRings: | 0 |
Unique Aglycone
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 |
AD44079
Formula: C5H7ON5
Smiles:
N=C1NC(=O)C2N=CNC2N1| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | -2.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 153.15 | Num_heavy_atoms: | 11 |
| TPSA: | 89.37 | NumAromaticRings: | 0 |
