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Details

Stereochemistry ACHIRAL
Molecular Formula C12H11I3N2O4
Molecular Weight 627.9402
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METRIZOIC ACID

SMILES

CN(C(C)=O)C1=C(I)C(NC(C)=O)=C(I)C(C(O)=O)=C1I

InChI

InChIKey=GGGDNPWHMNJRFN-UHFFFAOYSA-N
InChI=1S/C12H11I3N2O4/c1-4(18)16-10-7(13)6(12(20)21)8(14)11(9(10)15)17(3)5(2)19/h1-3H3,(H,16,18)(H,20,21)

HIDE SMILES / InChI

Description

Metrizoic acid is a diagnostic radiopaque that usually occurs as the sodium salt. The mechanism of action of metrizoic acid is as a X-Ray Contrast Activity.

Originator

Approval Year

1973
98
Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
Diagnostic
Approved
8429
ISOPAQUE 280

Approved Use

Unknown

Launch Date

1.36511996E11
Cmax

Cmax

ValueDoseCo-administeredAnalytePopulation
300 μg/mL
EXPERIMENT
https://pubmed.ncbi.nlm.nih.gov/3375780/
2310 mg single, intravenous
dose: 2310 mg
route of administration: Intravenous
experiment type: SINGLE
co-administered:
METRIZOIC ACID serum
Homo sapiens
population: HEALTHY
age: ADULT
sex: FEMALE
food status: UNKNOWN
AUC

AUC

ValueDoseCo-administeredAnalytePopulation
250 μg × h/mL
EXPERIMENT
https://pubmed.ncbi.nlm.nih.gov/3375780/
2310 mg single, intravenous
dose: 2310 mg
route of administration: Intravenous
experiment type: SINGLE
co-administered:
METRIZOIC ACID serum
Homo sapiens
population: HEALTHY
age: ADULT
sex: FEMALE
food status: UNKNOWN
T1/2

T1/2

ValueDoseCo-administeredAnalytePopulation
75.1 min
EXPERIMENT
https://pubmed.ncbi.nlm.nih.gov/3375780/
2310 mg single, intravenous
dose: 2310 mg
route of administration: Intravenous
experiment type: SINGLE
co-administered:
METRIZOIC ACID serum
Homo sapiens
population: HEALTHY
age: ADULT
sex: FEMALE
food status: UNKNOWN
Funbound

Funbound

ValueDoseCo-administeredAnalytePopulation
100%
EXPERIMENT
https://pubmed.ncbi.nlm.nih.gov/3375780/
2310 mg single, intravenous
dose: 2310 mg
route of administration: Intravenous
experiment type: SINGLE
co-administered:
METRIZOIC ACID serum
Homo sapiens
population: HEALTHY
age: ADULT
sex: FEMALE
food status: UNKNOWN
Sourcing

Sourcing

Vendor/AggregatorIDURL
ChEBI
CHEBI:34847
https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:34847
ChemicalBook
CB1775662
https://www.chemicalbook.com/ChemicalProductProperty_EN_CB1775662
MolPort
MolPort-006-147-732
https://www.molport.com/shop/molecule-link/MolPort-006-147-732
ZINC
ZINC000003831116
http://zinc15.docking.org/substances/ZINC000003831116
eMolecules
736293
https://www.emolecules.com/cgi-bin/more?vid=736293
PubMed

PubMed

TitleDatePubMed

Sample Use Guides

In Vivo Use Guide
0.35 mg/ml; 140.1 mg/ml; 461.8 mg/ml
Route of Administration: Intravascular
In Vitro Use Guide
Unknown
Name Type Language
METRIZOIC ACID
MART.   MI   ORANGE BOOK   WHO-DD  
Common Name English
Metrizoic acid [WHO-DD]
Common Name English
BENZOIC ACID, 3-(ACETYLAMINO)-5-(ACETYLMETHYLAMINO)-2,4,6-TRIIODO-
Common Name English
3-ACETAMIDO-2,4,6-TRI-IODO-5-(N-METHYLACETAMIDO)BENZOIC ACID
Systematic Name English
METRIZOIC ACID [JAN]
Common Name English
METRIZOIC ACID [MART.]
Common Name English
METRIZOIC ACID [MI]
Common Name English
V08AA02
Code English
METRIZOIC ACID [ORANGE BOOK]
Common Name English
Classification Tree Code System Code
NDF-RT N0000010258
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
WHO-ATC V08AA02
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
NDF-RT N0000180185
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
WHO-VATC QV08AA02
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
NCI_THESAURUS C390
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
Code System Code Type Description
DRUG BANK
DB09346
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY
SMS_ID
100000085979
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY
EPA CompTox
DTXSID6023311
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY
ECHA (EC/EINECS)
217-761-1
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY
NCI_THESAURUS
C76635
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY
DRUG CENTRAL
1789
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY
CHEBI
34847
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY
ChEMBL
CHEMBL1736
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY
CAS
1949-45-7
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY
MERCK INDEX
m7505
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY Merck Index
PUBCHEM
2528
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY
WIKIPEDIA
Metrizoic acid
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY
EVMPD
SUB03276MIG
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY
FDA UNII
CM1N99QR1M
Created by admin on Fri Dec 15 14:58:55 UTC 2023 , Edited by admin on Fri Dec 15 14:58:55 UTC 2023
PRIMARY
ACTIVE MOIETY
Structure of METRIZOIC ACID
SALT/SOLVATE (PARENT)
Structure of METRIZOATE CALCIUM
SALT/SOLVATE (PARENT)
Structure of METRIZOATE MEGLUMINE
SALT/SOLVATE (PARENT)
Structure of METRIZOATE SODIUM
SALT/SOLVATE (PARENT)
Structure of METRIZOATE MAGNESIUM
NIH
NCATS
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