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Details

Stereochemistry ABSOLUTE
Molecular Formula C11H9I3N2O4.C7H17NO5
Molecular Weight 809.1272
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IOTHALAMATE MEGLUMINE

SMILES

CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.CNC(=O)C1=C(I)C(NC(C)=O)=C(I)C(C(O)=O)=C1I

InChI

InChIKey=VLHUSFYMPUDOEL-WZTVWXICSA-N
InChI=1S/C11H9I3N2O4.C7H17NO5/c1-3(17)16-9-7(13)4(10(18)15-2)6(12)5(8(9)14)11(19)20;1-8-2-4(10)6(12)7(13)5(11)3-9/h1-2H3,(H,15,18)(H,16,17)(H,19,20);4-13H,2-3H2,1H3/t;4-,5+,6+,7+/m.0/s1

HIDE SMILES / InChI

Molecular Formula C11H9I3N2O4
Molecular Weight 613.9136
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C7H17NO5
Molecular Weight 195.2136
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:22:53 UTC 2023
Edited
by admin
on Fri Dec 15 15:22:53 UTC 2023
Record UNII
XUW72GOP7W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IOTHALAMATE MEGLUMINE
ORANGE BOOK   USP   VANDF  
Common Name English
IOTHALAMATE MEGLUMINE [ORANGE BOOK]
Common Name English
VASCORAY COMPONENT IOTHALAMATE MEGLUMINE
Common Name English
IOTHALAMATE MEGLUMINE COMPONENT OF VASCORAY
Common Name English
IOTHALAMATE MEGLUMINE [VANDF]
Common Name English
IOTHALAMIC ACID N-METHYLGLUCAMINE SALT [MI]
Common Name English
MEGLUMINE IOTHALAMATE
Common Name English
BENZOIC ACID, 3-(ACETYLAMINO)-2,4,6-TRIIODO-5-((METHYLAMINO)CARBONYL)-, COMPD. WITH 1-DEOXY-1-(METHYLAMINO)-D-GLUCITOL (1:1)
Common Name English
IOTHALAMATE MEGLUMINE [USP IMPURITY]
Common Name English
IOTALAMATE MEGLUMINE
WHO-DD  
Common Name English
MEGLUMINE IOTALAMATE [MART.]
Common Name English
Iotalamate meglumine [WHO-DD]
Common Name English
1-DEOXY-1-(METHYLAMINO)-D-GLUCITOL 5-ACETAMIDO-2,4,6-TRIIODO-N-METHYLISOPHTHALAMATE (SALT)
Common Name English
CONRAY
Brand Name English
MEGLUMINE IOTALAMATE
MART.  
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C28500
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
Code System Code Type Description
MERCK INDEX
m6377
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY Merck Index
NCI_THESAURUS
C47568
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY
FDA UNII
XUW72GOP7W
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY
ChEMBL
CHEMBL1201300
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY
EPA CompTox
DTXSID10926949
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY
CAS
13087-53-1
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY
DAILYMED
XUW72GOP7W
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY
ECHA (EC/EINECS)
235-998-9
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY
MESH
D007482
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY
DRUG BANK
DBSALT001235
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY
RXCUI
5971
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY RxNorm
CAS
519-25-5
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
SUPERSEDED
PUBCHEM
656642
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY
EVMPD
SUB02753MIG
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY
SMS_ID
100000086411
Created by admin on Fri Dec 15 15:22:53 UTC 2023 , Edited by admin on Fri Dec 15 15:22:53 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY