Analyte Name

(6R,7R)-3-((4-Carbamoylpyridin-1-ium-1-yl)methyl)-7-((R)-2-hydroxy-2-(thiophen-2-yl)acetamido)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Molecular Formula

C20H18N4O6S2

Molecular Weight

474.51

Accurate Mass

474.07

SMILES

[H][C@]12SCC(C[N+]3=CC=C(C(N)=O)C=C3)=C(N1C([C@H]2NC([C@H](C4=CC=CS4)O)=O)=O)C([O-])=O

InChI

InChI=1S/C20H18N4O6S2/c21-16(26)10-3-5-23(6-4-10)8-11-9-32-19-13(18(28)24(19)14(11)20(29)30)22-17(27)15(25)12-2-1-7-31-12/h1-7,13,15,19,25H,8-9H2,(H3-,21,22,26,27,29,30)/t13-,15+,19-/m1/s1

IUPAC

(6R,7R)-3-[(4-carbamoylpyridin-1-ium-1-yl)methyl]-7-[[(2R)-2-hydroxy-2-thiophen-2-ylacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat