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Chemical Entities of Biological Interest Ontology
Last uploaded:
January 1, 2025
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| Preferred Name | brimonidine tartrate | |
| Synonyms |
5-Bromo-6-(2-imidazolin-2-ylamino)quinoxaline D-tartrate (1:1) Brominide tartrate Alphagan P 5-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine (2R,3R)-2,3-dihydroxybutanedioic acid |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_51157 |
|
| charge |
0
|
|
| database_cross_reference |
KEGG:D02076 Beilstein:8885103 CAS:79570-19-7 DrugBank:DB00484
|
|
| formula |
C11H10BrN5.C4H6O6 C15H16BrN5O6
|
|
| has part | ||
| has_exact_synonym |
5-bromo-N-(4,5-dihydro-1H-imidazol-2-yl)quinoxalin-6-amine (2R,3R)-2,3-dihydroxybutanedioic acid
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
5-Bromo-6-(2-imidazolin-2-ylamino)quinoxaline D-tartrate (1:1) Brominide tartrate Alphagan P
|
|
| id |
CHEBI:51157
|
|
| in_subset | ||
| inchi |
InChI=1S/C11H10BrN5.C4H6O6/c12-9-7(17-11-15-5-6-16-11)1-2-8-10(9)14-4-3-13-8;5-1(3(7)8)2(6)4(9)10/h1-4H,5-6H2,(H2,15,16,17);1-2,5-6H,(H,7,8)(H,9,10)/t;1-,2-/m.0/s1
|
|
| inchikey |
QZHBYNSSDLTCRG-WUUYCOTASA-N
|
|
| label |
brimonidine tartrate
|
|
| mass |
442.22164
|
|
| monoisotopicmass |
441.02840
|
|
| notation |
CHEBI:51157
|
|
| prefLabel |
brimonidine tartrate
|
|
| smiles |
[H+].[H+].O[C@@H]([C@H](O)C([O-])=O)C([O-])=O.Brc1c(NC2=NCCN2)ccc2nccnc12
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| treeView | ||
| subClassOf |
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