Analytenname

(4S)-Ertapenem Disodium Salt

Molekularformel

C22H23N3Na2O7S

Molekulargewicht

519.48

Genaue Masse

519.11

SMILES

O=C1[C@]([C@]2([H])N1C(C(O[Na])=O)=C(S[C@@H]3CN[C@@H](C3)C(NC4=CC=CC(C(O[Na])=O)=C4)=O)[C@H]2C)([H])[C@H](O)C

InChI

InChI=1S/C22H25N3O7S.2Na/c1-9-16-15(10(2)26)20(28)25(16)17(22(31)32)18(9)33-13-7-14(23-8-13)19(27)24-12-5-3-4-11(6-12)21(29)30;;/h3-6,9-10,13-16,23,26H,7-8H2,1-2H3,(H,24,27)(H,29,30)(H,31,32);;/q;2*+1/p-2/t9-,10+,13-,14-,15+,16+;;/m0../s1

IUPAC

sodium (4S,5S,6S)-3-(((3S,5S)-5-((3-carboxylatophenyl)carbamoyl)pyrrolidin-3-yl)thio)-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate

Herkunftsland

CANADA

Produktformat

Neat