Sulfamethoxazole N4-glucoside[磺胺甲恶唑 N4-葡萄糖苷]

119691-75-7

CAS Name

4-(β-D-Glucopyranosylamino)-N-(5-methyl-3-isoxazolyl)benzenesulfonamide

Molecular Formula

C₁₆H₂₁N₃O₈S

Molecular Mass

415.42

Other Names and Identifiers

InChI

InChI=1S/C16H21N3O8S/c1-8-6-12(18-27-8)19-28(24,25)10-4-2-9(3-5-10)17-16-15(23)14(22)13(21)11(7-20)26-16/h2-6,11,13-17,20-23H,7H2,1H3,(H,18,19)/t11-,13-,14+,15-,16-/m1/s1

InChIKey

InChIKey=AKDUCXZSJFIYSD-YMILTQATSA-N

SMILES

N([C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C2=CC=C(S(NC3=NOC(C)=C3)(=O)=O)C=C2

Canonical SMILES

O=S(=O)(NC1=NOC(=C1)C)C2=CC=C(C=C2)NC3OC(CO)C(O)C(O)C3O

Other Names for this Substance