Glycoside
GD023093
Name:
NoneFormula:
C16H24O15N4P2Smiles:
O=P(O)(OC[C@@H]1OC(n2cnc3c(O)ncnc32)[C@H](O)[C@H]1O)OP(=O)(O)C1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
COP(=O)(O)O[PH](=O)O.Oc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.69 |
| AlogP: | -3.73 | Num_rotatable_bonds: | 8 |
| MolWt: | 574.33 | Num_heavy_atoms: | 37 |
| TPSA: | 296.73 | NumAromaticRings: | 2 |
Unique Aglycone
AD00956
Formula: C5H3ON4
Smiles:
Oc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 0 |
| MolWt: | 135.11 | Num_heavy_atoms: | 10 |
| TPSA: | 72.47 | NumAromaticRings: | 1 |
AD02733
Formula: CH6O6P2
Smiles:
COP(=O)(O)O[PH](=O)O| HBA: | 6 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | 0.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 176.0 | Num_heavy_atoms: | 9 |
| TPSA: | 93.06 | NumAromaticRings: | 0 |
