Glycoside
GD006646
Name:
NoneFormula:
C21H27O9N10PSmiles:
CP(=O)(OC[C@@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@H]1O)OC[C@@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@H]1OAglycone:
COP(C)(=O)OC.Nc1ncnc2c1N=C[N]2.Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1O.OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 0.52 |
| AlogP: | -2.07 | Num_rotatable_bonds: | 8 |
| MolWt: | 594.48 | Num_heavy_atoms: | 41 |
| TPSA: | 274.15 | NumAromaticRings: | 4 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
AD04869
Formula: C3H9O3P
Smiles:
COP(C)(=O)OC| HBA: | 3 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 1.0 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 2 |
| MolWt: | 124.08 | Num_heavy_atoms: | 7 |
| TPSA: | 35.53 | NumAromaticRings: | 0 |
