BUFROLIN

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H16N2O6
Molecular Weight	356.3294
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCC1=C2NC(=CC(=O)C2=C3NC(=CC(=O)C3=C1)C(O)=O)C(O)=O

InChI

InChIKey=BQVIONBNDNFCCP-UHFFFAOYSA-N

InChI=1S/C18H16N2O6/c1-2-3-4-8-5-9-12(21)6-10(17(23)24)20-16(9)14-13(22)7-11(18(25)26)19-15(8)14/h5-7H,2-4H2,1H3,(H,19,22)(H,20,21)(H,23,24)(H,25,26)

HIDE SMILES / InChI

Molecular Formula	C18H16N2O6
Molecular Weight	356.3294
Charge	0
Count

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

Description
Sources: https://www.ncbi.nlm.nih.gov/pubmed/24113750 | https://www.ncbi.nlm.nih.gov/pubmed/2833089 | https://www.ncbi.nlm.nih.gov/pubmed/6422727

Bufrolin is xanthine derivative and mast cell stabilizer with antiallergic activity. In recent studies, Bufrolin was found to be high potency agonists of human GPR35.

Originator

Approval Year

PubMed

Title	Date	PubMed
The antiallergic mast cell stabilizers lodoxamide and bufrolin as the first high and equipotent agonists of human and rat GPR35.	2014-01	24113750

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:17:05 GMT 2025` Edited by `admin` on `Mon Mar 31 18:17:05 GMT 2025`
Record UNII	46C1PX266N
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ICI-74917

Preferred Name

English

BUFROLIN

Official Name

English

BUFROLIN [MART.]

Common Name

English

6-BUTYL-1,4,7,10-TETRAHYDRO-4,10-DIOXO-1,7-PHENANTHROLINE-2,8-DICARBOXYLIC ACID

Systematic Name

English

bufrolin [INN]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29714