Glycoside
GD034759
Name:
NoneFormula:
C12H14O4N3ISmiles:
Nc1ccnc2c1c(I)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ccnc2c1C(I)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -0.17 | Num_rotatable_bonds: | 2 |
| MolWt: | 391.17 | Num_heavy_atoms: | 20 |
| TPSA: | 113.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD20338
Formula: C7H5N3I
Smiles:
Nc1ccnc2c1C(I)=C[N]2| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.65 | Num_rotatable_bonds: | 0 |
| MolWt: | 258.04 | Num_heavy_atoms: | 11 |
| TPSA: | 53.01 | NumAromaticRings: | 1 |
