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Details

Stereochemistry EPIMERIC
Molecular Formula C16H21N7O7S3
Molecular Weight 519.576
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-[[2-[(2-Amino-2-carboxyethyl)thio]acetyl]amino]-7-methoxy-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7S)-

SMILES

[H][C@]12SCC(CSC3=NN=NN3C)=C(N1C(=O)[C@]2(NC(=O)CSCC(N)C(O)=O)OC)C(O)=O

InChI

InChIKey=JSDXOWVAHXDYCU-MQWBZMFZSA-N
InChI=1S/C16H21N7O7S3/c1-22-15(19-20-21-22)33-4-7-3-32-14-16(30-2,13(29)23(14)10(7)12(27)28)18-9(24)6-31-5-8(17)11(25)26/h8,14H,3-6,17H2,1-2H3,(H,18,24)(H,25,26)(H,27,28)/t8?,14-,16+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
7-[[2-[(2-Amino-2-carboxyethyl)thio]acetyl]amino]-7-methoxy-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7S)-
Systematic Name English
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[[(2-amino-2-carboxyethyl)thio]acetyl]amino]-7-methoxy-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-, [6R-(6α,7α)]-
Systematic Name English
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[2-[(2-amino-2-carboxyethyl)thio]acetyl]amino]-7-methoxy-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-, (6R,7S)-
Systematic Name English
(6R,7S)-7-[[2-[(2-Amino-2-carboxyethyl)thio]acetyl]amino]-7-methoxy-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Systematic Name English
Code System Code Type Description
CAS
766459-15-8
Created by admin on Sat Dec 16 19:49:55 GMT 2023 , Edited by admin on Sat Dec 16 19:49:55 GMT 2023
PRIMARY
PUBCHEM
156345
Created by admin on Sat Dec 16 19:49:55 GMT 2023 , Edited by admin on Sat Dec 16 19:49:55 GMT 2023
PRIMARY
FDA UNII
USQ9747CU9
Created by admin on Sat Dec 16 19:49:55 GMT 2023 , Edited by admin on Sat Dec 16 19:49:55 GMT 2023
PRIMARY