loading...| Preferred Name | balsalazide | |
| Synonyms |
3-(2-{4-[(2-carboxyethyl)carbamoyl]phenyl}hydrazinylidene)-6-oxocyclohexa-1,4-diene-1-carboxylic acid (E)-5-({p-[(2-carboxyethyl)carbamoyl]phenyl}azo)-2-salicylic acid balsalazide balsalazida balsalazido 5-[4-(2-carboxy-ethylcarbamoyl)-phenylazo]-2-hydroxy-benzoic acid balsalazidum (E)-5-((4-(((2-carboxyethyl)amino)carbonyl)phenyl)azo)-2-hydroxybenzoic acid 5-[(E)-{4-[(2-carboxyethyl)carbamoyl]phenyl}diazenyl]-2-hydroxybenzoic acid |
|
| Definitions |
A monohydroxybenzoic acid consisting of 5-aminosalicylic acid (mesalazine) linked to 4-aminobenzoyl-beta-alanine via an azo bond. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_267413 |
|
| charge |
0 |
|
| database_cross_reference |
Wikipedia:Balsalazide Patent:GB2080796 CAS:80573-04-2 Reaxys:8081576 KEGG:D07488 DrugBank:DB01014 Patent:US4412992 Drug_Central:284 |
|
| definition |
A monohydroxybenzoic acid consisting of 5-aminosalicylic acid (mesalazine) linked to 4-aminobenzoyl-beta-alanine via an azo bond. |
|
| formula |
C17H15N3O6 |
|
| has role |
http://purl.obolibrary.org/obo/CHEBI_55324 http://purl.obolibrary.org/obo/CHEBI_35475 |
|
| has_exact_synonym |
5-[(E)-{4-[(2-carboxyethyl)carbamoyl]phenyl}diazenyl]-2-hydroxybenzoic acid |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
3-(2-{4-[(2-carboxyethyl)carbamoyl]phenyl}hydrazinylidene)-6-oxocyclohexa-1,4-diene-1-carboxylic acid (E)-5-({p-[(2-carboxyethyl)carbamoyl]phenyl}azo)-2-salicylic acid balsalazide balsalazida balsalazido 5-[4-(2-carboxy-ethylcarbamoyl)-phenylazo]-2-hydroxy-benzoic acid balsalazidum (E)-5-((4-(((2-carboxyethyl)amino)carbonyl)phenyl)azo)-2-hydroxybenzoic acid |
|
| id |
CHEBI:267413 |
|
| in_subset | ||
| inchi |
InChI=1S/C17H15N3O6/c21-14-6-5-12(9-13(14)17(25)26)20-19-11-3-1-10(2-4-11)16(24)18-8-7-15(22)23/h1-6,9,21H,7-8H2,(H,18,24)(H,22,23)(H,25,26)/b20-19+ |
|
| inchikey |
IPOKCKJONYRRHP-FMQUCBEESA-N |
|
| is conjugate acid of | ||
| label |
balsalazide |
|
| mass |
357.31750 |
|
| monoisotopicmass |
357.09609 |
|
| notation |
CHEBI:267413 |
|
| prefLabel |
balsalazide |
|
| smiles |
OC(=O)CCNC(=O)c1ccc(cc1)\N=N\c1ccc(O)c(c1)C(O)=O |
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| treeView | ||
| subClassOf |