Glycoside
GD010922
Name:
NoneFormula:
C24H32O9N10Smiles:
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COCCOCCNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1OAglycone:
COCCOCCNc1ncnc2c1N=C[N]2.Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1O.OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 0.58 |
| AlogP: | -3.08 | Num_rotatable_bonds: | 12 |
| MolWt: | 604.58 | Num_heavy_atoms: | 43 |
| TPSA: | 263.32 | 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 |
AD08381
Formula: C10H14O2N5
Smiles:
COCCOCCNc1ncnc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 0.46 | Num_rotatable_bonds: | 7 |
| MolWt: | 236.26 | Num_heavy_atoms: | 17 |
| TPSA: | 82.73 | NumAromaticRings: | 1 |
