IODOPHTHALEIN

Investigational

Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H10I4O4
Molecular Weight	821.9089
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

SMILES

OC1=C(I)C=C(C=C1I)C2(OC(=O)C3=CC=CC=C23)C4=CC(I)=C(O)C(I)=C4

InChI

InChIKey=FWQKRBDABCRWKV-UHFFFAOYSA-N

InChI=1S/C20H10I4O4/c21-13-5-9(6-14(22)17(13)25)20(10-7-15(23)18(26)16(24)8-10)12-4-2-1-3-11(12)19(27)28-20/h1-8,25-26H

HIDE SMILES / InChI

Molecular Formula	C20H10I4O4
Molecular Weight	821.9089
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Description

Iodophthalein was used as an iodine-containing X-ray contrast agent in icteric subjects. There is also existed mention, that iodophthalein has also been used as a wound treatment, and for the treatment of intestinal catarrhs. But nowadays more modern drugs are being used.

Approval Year

Targets

Primary Target	Pharmacology	Potency
Beta-lactamase AmpC 3	Inhibitor 8,504	3.0 µM [IC50]
Chymotrypsin C 2	Inhibitor 8,504	11.0 µM [IC50]
Dihydrofolate reductase 61	Inhibitor 8,504	20.0 µM [IC50]
Beta-galactosidase 4	Inhibitor 8,504	200.0 µM [IC50]

Conditions

Condition	Modality	Targets	Highest Phase	Product
Jaundice 1	Diagnostic		Not Provided 511	Unknown

PubMed

PubMed

Show entries

Title	Date	PubMed
The excretion of iodophthalein in the human organism, with a method for determination of iodophthalein in tissue fluids.	1948	18859476
The elimination of iodophthalein in normal and icteric subjects.	1949 Jul 18	18143449
Radiopaque contrast media XXXI-Glucoside conjugation of iodophthalein in rabbit.	1977 Jan	844606

Showing 1 to 3 of 3 entries

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Sample Use Guides

In Vivo Use Guide

Unknown

Route of Administration: Unknown

In Vitro Use Guide

Unknown

Substance Class	Chemical
Record UNII	R2CC46UA50
Record Status	`Validated (UNII)`
Record Version

Show entries

Name

Type

Language

IODOPHTHALEIN

Common Name

English

IODOPHTHALEIN SODIUM FREE ACID

Preferred Name

English

TETRAIODOPHENOLPHTHALEIN

Common Name

English

3,3',5,5'-TETRAIODOPHENOLPHTHALEIN

Common Name

English

NOSOPHEN

Brand Name

English

Showing 1 to 5 of 12 entries

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Code System

Code

Type

Description

EPA CompTox

DTXSID7048291

PRIMARY

MERCK INDEX

m6351

PRIMARY

Merck Index

NSC

164900

PRIMARY

PUBCHEM

67846

PRIMARY

ECHA (EC/EINECS)

206-857-9

PRIMARY

Showing 1 to 5 of 8 entries

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SMILES

InChI

Description<div class="info-popup-container"><div><span class="pop-sub-key ">Sources:&nbsp;</span><span class="pop-sub-val"><span class="ext-link"><a target="_self" href="https://www.ncbi.nlm.nih.gov/pubmed/18143449">https://www.ncbi.nlm.nih.gov/pubmed/18143449</a></span></span></div></div>

Approval Year

Targets

Conditions

PubMed

Sample Use Guides

Description