Grundinformationen
- CAS
27293-82-9- Standard-SMILES
CCCC(=O)Nc1c(I)cc(I)c(CC(CC)C(=O)O)c1I- InChIKey
YMOXVLQZFAUUKI-UHFFFAOYSA-N- Summenformel
- C15H18I3NO3
- Durchschnittliche Molmasse
- 641,02 g/mol
- Monoisotopische Masse
- 640,8421
Überblick
Tyropanoate is a member of benzenes and a monocarboxylic acid.
Namen und Bezeichner
- Bevorzugter Name
- Tyropanic Acid
- IUPAC
- 2-[[3-(butanoylamino)-2,4,6-triiodophenyl]methyl]butanoic acid
- Lokaler Name
- 2-[3-(Butyrylamino)-2,4,6-triiodbenzyl]buttersure
- Englischer Name
- 2-[3-(butyrylamino)-2,4,6-triiodobenzyl]butyric acid
- Summenformel
- C15H18I3NO3
- Molmasse
- 641.02
Namen und Synonyme
Tyropanoic acidTYROPANIC ACID27293-82-9Acidum tyropanoicum4F05V145YREINECS 248-389-82-[(3-butanamido-2,4,6-triiodophenyl)methyl]butanoic acidDTXSID5048269TYROPANOIC ACID [WHO-DD]2-(3-(Butyrylamino)-2,4,6-triiodobenzyl)butanoic acid2-((3-butanamido-2,4,6-triiodophenyl)methyl)butanoic acidRefChem:900814
Weitere Namen anzeigen
Tyropanoateα-Ethyl-2,4,6-triiodo-3-[(1-oxobutyl)amino]benzenepropanoic acidBenzenepropanoic acid, α-ethyl-2,4,6-triiodo-3-[(1-oxobutyl)amino]-
DTXCID00282442-[[3-(butanoylamino)-2,4,6-triiodophenyl]methyl]butanoic acid2-[3-(BUTYRYLAMINO)-2,4,6-TRIIODOBENZYL]BUTYRIC ACID2-(3-Butyramido-2,4,6-triiodobenzyl)butanoic acidBilopacLumopaqueTyropaqueBenzenepropanoic acid, a-ethyl-2,4,6-triiodo-3-[(1-oxobutyl)amino]-
Datenbank-Bezeichner
- CAS
27293-82-9
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 4,6
- Polarare Oberfläche (TPSA)
- 66,4 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 7
- Schwere Atome
- 22
- Formalladung
- 0
- Komplexität
- 394
Experimentelle und physikochemische Eigenschaften
Solubilityslightly water soluble
Boiling Point>187
Physikochemische Eigenschaften
- Schmelzpunkt
- 172 · 172-185.5 °C
- Siedepunkt
- 608.7 · 608.7±55.0 °C(Predicted)
- Dichte
- 2.143 · 2.143±0.06 g/cm3(Predicted)
- pka
- 4.53 · 4.53±0.19(Predicted)
Chemie und Industrie
Pharmakologische Informationen
ATC Code
V - Various
QV - Various
Protein BindingLess than 5 %.
Pharmacodynamics
Tyropanoate sodium, also known as sodium tyropanoate, is a radiocontrast agent used in cholecystography (X-ray imagining and diagnosis of gallstones). This molecule contains three heavy iodine atoms which obstruct X-rays to produce a visible image. After injection, it is rapidly excreted into the bile.
Metabolism/MetabolitesConjugated with glucuronic acid in the liver.
Absorption, Distribution and Excretion
This triiodide is well absorbed by the small intestine and it is excreted in the bile within 2 h after oral administration. It has been found to be readily absorbed and show maximal radiographic definition at 10-12 h post ingestion, but this can occur as early as 4-6h.
Rapidly excreted into the bile and equally excreted in the urine and feces within 100h of ingestion.
Anwendungen
VerwendenTyropanoic Acid acts as a cholecystographic agent that interferes with the binding of thyroid hormones.
Anbieter4 Anbieter
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Zugehörige Reaktionen
0
Keine Reaktionsaufzeichnungen unter den aktuellen Filterkriterien.
Notizen zur Verbindung
Wird geladen…