U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C12H11I3N2O5
Molecular Weight 643.9396
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IOXITALAMIC ACID

SMILES

CC(=O)NC1=C(I)C(C(O)=O)=C(I)C(C(=O)NCCO)=C1I

InChI

InChIKey=OLAOYPRJVHUHCF-UHFFFAOYSA-N
InChI=1S/C12H11I3N2O5/c1-4(19)17-10-8(14)5(11(20)16-2-3-18)7(13)6(9(10)15)12(21)22/h18H,2-3H2,1H3,(H,16,20)(H,17,19)(H,21,22)

HIDE SMILES / InChI

Molecular Formula C12H11I3N2O5
Molecular Weight 643.9396
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:25:10 UTC 2023
Edited
by admin
on Fri Dec 15 16:25:10 UTC 2023
Record UNII
967RDI7Z6K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IOXITALAMIC ACID
INN   MART.   WHO-DD  
INN  
Official Name English
Ioxitalamic acid [WHO-DD]
Common Name English
AG 58107
Code English
AG-58107
Code English
IOXITHALAMIC ACID
Common Name English
ioxitalamic acid [INN]
Common Name English
IOXITALAMIC ACID [MART.]
Common Name English
5-ACETAMIDO-N-(2-HYDROXYETHYL)-2,4,6-TRIIODOISOPHTHALAMIC ACID
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C28500
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
WHO-VATC QV08AA05
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
WHO-ATC V08AA05
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
Code System Code Type Description
DRUG BANK
DB13444
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
EPA CompTox
DTXSID60182457
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
CAS
28179-44-4
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
ECHA (EC/EINECS)
248-887-5
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
SMS_ID
100000083117
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
PUBCHEM
34536
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
ChEMBL
CHEMBL2107239
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
DRUG CENTRAL
4582
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
FDA UNII
967RDI7Z6K
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
MESH
C002587
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
EVMPD
SUB08266MIG
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
NCI_THESAURUS
C65949
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
WIKIPEDIA
Ioxitalamic acid
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
INN
2742
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
CHEBI
83517
Created by admin on Fri Dec 15 16:25:10 UTC 2023 , Edited by admin on Fri Dec 15 16:25:10 UTC 2023
PRIMARY
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ACTIVE MOIETY