Glycoside
GD098192
Name:
NoneFormula:
C14H20O5N5ISmiles:
CC(C)(O)CNc1nc(I)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CC(C)(O)CNc1nc(I)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -0.77 | Num_rotatable_bonds: | 5 |
| MolWt: | 465.25 | Num_heavy_atoms: | 25 |
| TPSA: | 145.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD41781
Formula: C9H11ON5I
Smiles:
CC(C)(O)CNc1nc(I)nc2c1N=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 332.13 | Num_heavy_atoms: | 16 |
| TPSA: | 84.5 | NumAromaticRings: | 1 |
