Glycoside
GD098191
Name:
NoneFormula:
C15H21O5N4ISmiles:
CC(C)(O)CNc1ncnc2c1c(I)cn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CC(C)(O)CNc1ncnc2c1C(I)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.6 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 5 |
| MolWt: | 464.26 | Num_heavy_atoms: | 25 |
| TPSA: | 132.89 | NumAromaticRings: | 2 |
Unique Aglycone
AD41780
Formula: C10H12ON4I
Smiles:
CC(C)(O)CNc1ncnc2c1C(I)=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 3 |
| MolWt: | 331.14 | Num_heavy_atoms: | 16 |
| TPSA: | 72.14 | NumAromaticRings: | 1 |
