ZM 213689-d6 Disodium Salt (Meropenem Impurity)(Mixture of double bond isomers)

Analyte Name

ZM 213689-d6 Disodium Salt (Meropenem Impurity)(Mixture of double bond isomers)

Molecular Formula

C34H38D12N6Na4O12S2

Molecular Weight

902.96

Accurate Mass

902.33

SMILES

O[C@H](C)[C@@]([H])(C(O[Na])=O)C1[C@@H](C)[C@@](S[C@H]2C[C@@H](C(N(C([2H])([2H])[2H])C([2H])([2H])[2H])=O)NC2)([H])C(C(O[Na])=O)=N1.O[C@H](C)[C@@]([H])(C(O[Na])=O)C3[C@@H](C)C(S[C@H]4C[C@@H](C(N(C([2H])([2H])[2H])C([2H])([2H])[2H])=O)NC4)=C(C(O[Na])=O)N3

InChI

InChI=1S/2C17H27N3O6S.4Na/c2*1-7-12(11(8(2)21)16(23)24)19-13(17(25)26)14(7)27-9-5-10(18-6-9)15(22)20(3)4;;;;/h7-12,18-19,21H,5-6H2,1-4H3,(H,23,24)(H,25,26);7-12,14,18,21H,5-6H2,1-4H3,(H,23,24)(H,25,26);;;;/q;;4*+1/p-4/t7-,8-,9+,10+,11-,12?;7-,8-,9+,10+,11-,12?,14+;;;;/m11..../s1/i2*3D3,4D3;;;;

IUPAC

sodium (3R,4S)-4-(((3S,5S)-5-(bis(methyl-d3)carbamoyl)pyrrolidin-3-yl)thio)-2-((1S,2R)-1-carboxylato-2-hydroxypropyl)-3-methyl-3,4-dihydro-2H-pyrrole-5-carboxylate (4R)-3-(((3S,5S)-5-(bis(methyl-d3)carbamoyl)pyrrolidin-3-yl)thio)-5-((1S,2R)-1-carboxylato-2-hydroxypropyl)-4-methyl-4,5-dihydro-1H-pyrrole-2-carboxylate

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat