Glycoside
GD098147
Name:
NoneFormula:
C13H14O7N3ISmiles:
COc1nccc(-c2noc([C@H]3O[C@@H](O)[C@H](O)[C@@H](O)[C@H]3O)n2)c1IAglycone:
COc1nccc(-c2ncon2)c1ISugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 451.17 | Num_heavy_atoms: | 24 |
| TPSA: | 151.19 | NumAromaticRings: | 2 |
Unique Aglycone
AD41747
Formula: C8H6O2N3I
Smiles:
COc1nccc(-c2ncon2)c1I| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 1.74 | Num_rotatable_bonds: | 2 |
| MolWt: | 303.06 | Num_heavy_atoms: | 14 |
| TPSA: | 61.04 | NumAromaticRings: | 2 |
