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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H8I3NO6
Molecular Weight 630.8977
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-[[(2S)-2-Hydroxypropanoyl]amino]-2,4,6-triiodobenzene-1,3-dicarboxylic acid

SMILES

C[C@H](O)C(=O)NC1=C(I)C(C(O)=O)=C(I)C(C(O)=O)=C1I

InChI

InChIKey=GOCIYSIBXXQUAW-REOHCLBHSA-N
InChI=1S/C11H8I3NO6/c1-2(16)9(17)15-8-6(13)3(10(18)19)5(12)4(7(8)14)11(20)21/h2,16H,1H3,(H,15,17)(H,18,19)(H,20,21)/t2-/m0/s1

HIDE SMILES / InChI

Molecular Formula C11H8I3NO6
Molecular Weight 630.8977
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:16:38 GMT 2025
Edited
by admin
on Wed Apr 02 19:16:38 GMT 2025
Record UNII
QBS6NER7B9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-[[(2S)-2-Hydroxypropanoyl]amino]-2,4,6-triiodobenzene-1,3-dicarboxylic acid
Preferred Name English
Code System Code Type Description
PUBCHEM
87098967
Created by admin on Wed Apr 02 19:16:38 GMT 2025 , Edited by admin on Wed Apr 02 19:16:38 GMT 2025
PRIMARY
FDA UNII
QBS6NER7B9
Created by admin on Wed Apr 02 19:16:38 GMT 2025 , Edited by admin on Wed Apr 02 19:16:38 GMT 2025
PRIMARY