Glycoside
GD139754
Name:
6-{[6-(4-aminobenzenesulfonamido)pyridin-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acidFormula:
C17H19O9N3SSmiles:
Nc1ccc(S(=O)(=O)Nc2ccc(OC3OC(C(=O)O)C(O)C(O)C3O)cn2)cc1Aglycone:
Nc1ccc(S(=O)(=O)Nc2ccc(O)cn2)cc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.29 |
| AlogP: | -1.26 | Num_rotatable_bonds: | 6 |
| MolWt: | 441.42 | Num_heavy_atoms: | 30 |
| TPSA: | 201.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD56357
Formula: C11H11O3N3S
Smiles:
Nc1ccc(S(=O)(=O)Nc2ccc(O)cn2)cc1| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 1.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 265.29 | Num_heavy_atoms: | 18 |
| TPSA: | 105.31 | NumAromaticRings: | 2 |
