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The Drug Ontology
Last uploaded:
December 20, 2024
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| Id | http://purl.obolibrary.org/obo/CHEBI_267413
http://purl.obolibrary.org/obo/CHEBI_267413
|
|---|---|
| Preferred Name | balsalazide |
| Definitions |
A monohydroxybenzoic acid consisting of 5-aminosalicylic acid (mesalazine) linked to 4-aminobenzoyl-beta-alanine via an azo bond.
|
| Synonyms |
balsalazida
balsalazido
balsalazide
5-[4-(2-carboxy-ethylcarbamoyl)-phenylazo]-2-hydroxy-benzoic acid
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
(E)-5-((4-(((2-carboxyethyl)amino)carbonyl)phenyl)azo)-2-hydroxybenzoic acid
balsalazidum
5-[(E)-{4-[(2-carboxyethyl)carbamoyl]phenyl}diazenyl]-2-hydroxybenzoic acid
|
| Type | http://www.w3.org/2002/07/owl#Class |
All Properties
| definition | A monohydroxybenzoic acid consisting of 5-aminosalicylic acid (mesalazine) linked to 4-aminobenzoyl-beta-alanine via an azo bond. |
|---|---|
| label |
balsalazide
|
| prefLabel |
balsalazide
|
| database_cross_reference |
Drug_Central:284
DrugBank:DB01014
KEGG:D07488
CAS:80573-04-2
Reaxys:8081576
Patent:GB2080796
Patent:US4412992
Wikipedia:Balsalazide
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|
| notation |
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+
|
| has_related_synonym |
balsalazida
balsalazido
balsalazide
5-[4-(2-carboxy-ethylcarbamoyl)-phenylazo]-2-hydroxy-benzoic acid
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
(E)-5-((4-(((2-carboxyethyl)amino)carbonyl)phenyl)azo)-2-hydroxybenzoic acid
balsalazidum
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|
| id |
CHEBI:267413
|
| charge |
0
|
| has_obo_namespace |
chebi_ontology
|
| formula |
C17H15N3O6
|
| subClassOf | |
| inchikey |
IPOKCKJONYRRHP-FMQUCBEESA-N
|
| mass |
357.31750
|
| monoisotopicmass |
357.09609
|
| type | |
| smiles |
OC(=O)CCNC(=O)c1ccc(cc1)\N=N\c1ccc(O)c(c1)C(O)=O
|
| has_RxCUI |
18747
|
| has role | |
| has_exact_synonym |
5-[(E)-{4-[(2-carboxyethyl)carbamoyl]phenyl}diazenyl]-2-hydroxybenzoic acid
|
| has characteristic | |
| alternative label |
balsalazida
balsalazido
balsalazide
5-[4-(2-carboxy-ethylcarbamoyl)-phenylazo]-2-hydroxy-benzoic acid
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
(E)-5-((4-(((2-carboxyethyl)amino)carbonyl)phenyl)azo)-2-hydroxybenzoic acid
balsalazidum
5-[(E)-{4-[(2-carboxyethyl)carbamoyl]phenyl}diazenyl]-2-hydroxybenzoic acid
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|
| is conjugate acid of |
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