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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H18N4O7
Molecular Weight 392.34
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 4-nitrobenzyl (R)-2-diazo-4-((2R,3S)-3-((R)-1-hydroxyethyl)-4-oxoazetidin-2-yl)-3-oxopentanoate-2-<SUP>14</SUP>C

SMILES

C[C@@H](O)[C@@H]1[C@H](NC1=O)[C@@H](C)C(=O)[14C](=[N+]=[N-])C(=O)OCC2=CC=C(C=C2)[N+]([O-])=O

InChI

InChIKey=FDXUXRZSNNSUGD-IVDJOYJUSA-N
InChI=1S/C17H18N4O7/c1-8(13-12(9(2)22)16(24)19-13)15(23)14(20-18)17(25)28-7-10-3-5-11(6-4-10)21(26)27/h3-6,8-9,12-13,22H,7H2,1-2H3,(H,19,24)/t8-,9-,12-,13-/m1/s1/i14+2

HIDE SMILES / InChI

Molecular Formula C17H18N4O7
Molecular Weight 392.34
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 18:03:50 GMT 2025
Edited
by admin
on Wed Apr 02 18:03:50 GMT 2025
Record UNII
9LYL8CRR6L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-nitrobenzyl (R)-2-diazo-4-((2R,3S)-3-((R)-1-hydroxyethyl)-4-oxoazetidin-2-yl)-3-oxopentanoate-2-<SUP>14</SUP>C
Systematic Name English
2-Azetidinebutanoic-?-<SUP>14</SUP>C acid, ?-diazo-3-(1-hydroxyethyl)-?-methyl-?,4-dioxo-, (4-nitrophenyl)methyl ester, [2R-[2?(R*),3?(R*)]]-
Preferred Name English
Code System Code Type Description
PUBCHEM
137179743
Created by admin on Wed Apr 02 18:03:50 GMT 2025 , Edited by admin on Wed Apr 02 18:03:50 GMT 2025
PRIMARY
CAS
137391-68-5
Created by admin on Wed Apr 02 18:03:50 GMT 2025 , Edited by admin on Wed Apr 02 18:03:50 GMT 2025
PRIMARY
EPA CompTox
DTXSID10720045
Created by admin on Wed Apr 02 18:03:50 GMT 2025 , Edited by admin on Wed Apr 02 18:03:50 GMT 2025
PRIMARY
FDA UNII
9LYL8CRR6L
Created by admin on Wed Apr 02 18:03:50 GMT 2025 , Edited by admin on Wed Apr 02 18:03:50 GMT 2025
PRIMARY