Glycoside
GD090742
Name:
NoneFormula:
C21H25O6N5Smiles:
COC(=O)[C@](C)(CNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)c1ccccc1Aglycone:
COC(=O)C(C)(CNc1ncnc2c1N=C[N]2)c1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | -0.02 | Num_rotatable_bonds: | 7 |
| MolWt: | 443.46 | Num_heavy_atoms: | 32 |
| TPSA: | 151.85 | NumAromaticRings: | 3 |
Unique Aglycone
AD39502
Formula: C16H16O2N5
Smiles:
COC(=O)C(C)(CNc1ncnc2c1N=C[N]2)c1ccccc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 5 |
| MolWt: | 310.34 | Num_heavy_atoms: | 23 |
| TPSA: | 90.57 | NumAromaticRings: | 2 |
