Glycoside
GD020142
Name:
NoneFormula:
C11H19O13N7P3Smiles:
N=C1N=C(N)N=C(N)C2N=CN(C3O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)([O-])O)[C@H](O)[C@H]3O)C12Aglycone:
COP(=O)(O)OP(=O)(O)OP(=O)([O-])O.N=C1N=C(N)N=C(N)C2N=CNC12Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 20 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 0.64 |
| AlogP: | -4.11 | Num_rotatable_bonds: | 8 |
| MolWt: | 550.23 | Num_heavy_atoms: | 34 |
| TPSA: | 328.55 | NumAromaticRings: | 0 |
Unique Aglycone
AD03567
Formula: C6H9N7
Smiles:
N=C1N=C(N)N=C(N)C2N=CNC12| HBA: | 7 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | -1.98 | Num_rotatable_bonds: | 0 |
| MolWt: | 179.19 | Num_heavy_atoms: | 13 |
| TPSA: | 125.0 | NumAromaticRings: | 0 |
AD09054
Formula: CH6O10P3
Smiles:
COP(=O)(O)OP(=O)(O)OP(=O)([O-])O| HBA: | 10 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 5 |
| MolWt: | 270.97 | Num_heavy_atoms: | 14 |
| TPSA: | 162.65 | NumAromaticRings: | 0 |
