Glycoside
GD091790
Name:
NoneFormula:
C14H16O5N3ISmiles:
OC[C@H]1O[C@@H](O)[C@H](n2cc(-c3ccc(I)cc3)nn2)[C@@H](O)[C@@H]1OAglycone:
Ic1ccc(C2=C[N]N=N2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | -0.48 | Num_rotatable_bonds: | 3 |
| MolWt: | 433.2 | Num_heavy_atoms: | 23 |
| TPSA: | 120.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD40015
Formula: C8H5N3I
Smiles:
Ic1ccc(C2=C[N]N=N2)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 2.57 | Num_rotatable_bonds: | 1 |
| MolWt: | 270.05 | Num_heavy_atoms: | 12 |
| TPSA: | 38.82 | NumAromaticRings: | 1 |
