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Ioglycamic acid

CAT: 0013-GTR19223474-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19223474-02Size:500 mg
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Description
Iodoxylic acid, formulated as meglumine and sodium salts, is a radiopaque contrast agent specifically designed for biliary tract imaging. It is utilized in diagnostic research for in vivo visualization of the hepatic and biliary duct systems during radiographic procedures.
CAS Number
2618-25-9
Field of Research
Pharmacology & Drug Discovery
Smiles
O=C (O) C=1C (I) =CC (I) =C (NC (=O) COCC (=O) NC2=C (I) C=C (I) C (C (=O) O) =C2I) C1I
Molecular Formula
C18H10I6N2O7
Molecular Weight
1127.71
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Ioglycamic Acid

Ioglycamic acid is an amidobenzoic acid.

CAS Number2618-25-9
PubChem CID17477
IUPAC Name3-[[2-[2-(3-carboxy-2,4,6-triiodoanilino)-2-oxoethoxy]acetyl]amino]-2,4,6-triiodobenzoic acid
Molecular FormulaC18H10I6N2O7
Molecular Weight1127.7
XLogP4.8
Topological Polar Surface Area142
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Heavy Atom Count33
Formal Charge0
Complexity702
SMILES
C1=C(C(=C(C(=C1I)NC(=O)COCC(=O)NC2=C(C=C(C(=C2I)C(=O)O)I)I)I)C(=O)O)I
InChI
InChI=1S/C18H10I6N2O7/c19-5-1-7(21)15(13(23)11(5)17(29)30)25-9(27)3-33-4-10(28)26-16-8(22)2-6(20)12(14(16)24)18(31)32/h1-2H,3-4H2,(H,25,27)(H,26,28)(H,29,30)(H,31,32)
InChIKey
FZDZULUFHNDEDJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ioglycamic Acid
CAS: 2618-25-9
CID: 17477
Formula: C18H10I6N2O7
MW: 1127.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1127.7
XLogP34.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count8
Exact Mass1127.4756
Monoisotopic Mass1127.4756
Topological Polar Surface Area142 Ų
Heavy Atom Count33
Formal Charge0
Complexity702
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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