Ertapenem Impurity 25

CAT No.

ALN-E049041

CAS No.

866317-77-3

Mol. F.

C29H32N4O7S

Mol. Wt.

580.7

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Product Overview

Technical Data

Reference

RFQ

Product Overview

Chemical Name : (4R,5S,6S)-3-(((3S,5S)-1-(4-aminobenzyl)-5-((3-carboxyphenyl)carbamoyl)pyrrolidin-3-yl)thio)-6-((R)-1-hydroxyethyl)-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Smiles : O=C(C(N12)=C(S[C@@H]3CN(CC4=CC=C(N)C=C4)[C@H](C(NC5=CC=CC(C(O)=O)=C5)=O)C3)[C@H](C)[C@]2([H])[C@@H]([C@H](O)C)C1=O)O

Inchi : InChI=1S/C44H48N6O13S2/c1-17-31-29(19(3)51)39(54)49(31)33(42(58)59)35(17)64-25-13-28(46-15-25)38(53)48-24-10-6-8-22(12-24)44(62)63-20(4)30-32-18(2)36(34(43(60)61)50(32)40(30)55)65-26-14-27(45-16-26)37(52)47-23-9-5-7-21(11-23)41(56)57/h5-12,17-20,25-32,45-46,51H,13-16H2,1-4H3,(H,47,52)(H,48,53)(H,56,57)(H,58,59)(H,60,61)/t17-,18-,19-,20-,25+,26+,27-,28-,29-,30-,31-,32-/m1/s1

Technical Data