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O-Iodohippurate sodium

CAT: 0931-T33785-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T33785-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
133-17-5
Target
Others
Related Pathways
Others
Bioactivity
O-Iodohippurate sodium is an analogue of p-aminohippuric acid used to determine effective renal plasma flow. Labelled OIH has a higher clearance than other radiopharmaceutical yet developed and is extremely suitable for renography. It is eliminated mainly by tubular secretion. In patients with normally functioning kidneys, 85% of the OIH may exist in the urine after intravenous injection for 30 minutes.
Smiles
[Na].OC(=O)CNC(=O)c1ccccc1I
Molecular Formula
C9H7INNaO3
Molecular Weight
327.05
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Iodohippurate Sodium

Sodium 2-iodohippurate is an organic sodium salt resulting from the formal reaction of equimolar amounts of 2-iodohippuric acid and sodium. It has been used as a contrast agent in urography. Isotopologues labelled with radioactive iodine were formerly used for determination of effective renal plasma flow. It has also been used labelled with radioactive iodine (iodine-125 or iodine-131) in tests of renal function and in renal imaging. It has a role as a radioopaque medium. It contains a 2-iodohippurate.

CAS Number133-17-5
PubChem CID23689317
IUPAC Namesodium 2-[(2-iodobenzoyl)amino]acetate
Molecular FormulaC9H7INNaO3
Molecular Weight327.05
Topological Polar Surface Area69.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count15
Formal Charge0
Complexity237
SMILES
C1=CC=C(C(=C1)C(=O)NCC(=O)[O-])I.[Na+]
InChI
InChI=1S/C9H8INO3.Na/c10-7-4-2-1-3-6(7)9(14)11-5-8(12)13;/h1-4H,5H2,(H,11,14)(H,12,13);/q;+1/p-1
InChIKey
XYITYKDGJLHYPW-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Iodohippurate Sodium
CAS: 133-17-5
CID: 23689317
Formula: C9H7INNaO3
MW: 327.05
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight327.05
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass326.93683
Monoisotopic Mass326.93683
Topological Polar Surface Area69.2 Ų
Heavy Atom Count15
Formal Charge0
Complexity237
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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