Nome dell'analita

Ertapenem N-tert-Butyloxycarbonyl Methyl Ester Sodium Salt

Formula molecolare

C28 H34 N3 Na O9 S

Peso molecolare

611.639

Massa accurata

611.191

SMILES

COC(=O)c1cccc(NC(=O)[C@H]2C[C@H](CN2C(=O)OC(C)(C)C)SC3=C(N4[C@H]([C@H]3C)[C@@H]([C@@H](C)O)C4=O)C(=O)O[Na])c1

InChI

InChI=1S/C28H35N3O9S.Na/c1-13-20-19(14(2)32)24(34)31(20)21(25(35)36)22(13)41-17-11-18(30(12-17)27(38)40-28(3,4)5)23(33)29-16-9-7-8-15(10-16)26(37)39-6;/h7-10,13-14,17-20,32H,11-12H2,1-6H3,(H,29,33)(H,35,36);/q;+1/p-1/t13-,14-,17-,18-,19-,20-;/m1./s1

IUPAC

[(4R,5S,6S)-6-[(1R)-1-hydroxyethyl]-3-[(3R,5R)-5-[(3-methoxycarbonylphenyl)carbamoyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]sulfanyl-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carbonyl]oxysodium

CAS alternativo

Parent Compound: 153832-46-3

Temperatura di spedizione

Room Temperature

Paese di origine

CANADA

Formato del prodotto

Neat