Glycoside
GD029313
Name:
NoneFormula:
C17H23O13N6P3Smiles:
COc1ccc(NP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@@H]2O[C@H](n3cnc4c(N)ncnc43)[C@H](O)[C@H]2O)cc1Aglycone:
COc1ccc(NP(=O)(O)OP(=O)(O)OP(=O)(O)OC)cc1.Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.35 |
| AlogP: | 0.5 | Num_rotatable_bonds: | 11 |
| MolWt: | 612.32 | Num_heavy_atoms: | 39 |
| TPSA: | 280.16 | NumAromaticRings: | 3 |
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 |
AD19079
Formula: C8H14O10NP3
Smiles:
COc1ccc(NP(=O)(O)OP(=O)(O)OP(=O)(O)OC)cc1| HBA: | 11 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.25 |
| AlogP: | 2.09 | Num_rotatable_bonds: | 8 |
| MolWt: | 377.12 | Num_heavy_atoms: | 22 |
| TPSA: | 160.85 | NumAromaticRings: | 1 |
