CHEBI:267413 - balsalazide

ChEBI IDCHEBI:267413
ChEBI Namebalsalazide
Stars
DefinitionA monohydroxybenzoic acid consisting of 5-aminosalicylic acid (mesalazine) linked to 4-aminobenzoyl-β-alanine via an azo bond.
Last Modified22 February 2017
DownloadsMolfile
FormulaC17H15N3O6
Net Charge0
Average Mass357.322
Monoisotopic Mass357.09609
SMILESO=C(O)CCNC(=O)c1ccc(/N=N/c2ccc(O)c(C(=O)O)c2)cc1
InChIInChI=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+
InChIKeyIPOKCKJONYRRHP-FMQUCBEESA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Applications:
gastrointestinal drug  A drug used for its effects on the gastrointestinal system, e.g. controlling gastric acidity, regulating gastrointestinal motility and water flow, and improving digestion.
prodrug  A compound that, on administration, must undergo chemical conversion by metabolic processes before becoming the pharmacologically active drug for which it is a prodrug.
non-steroidal anti-inflammatory drug  An anti-inflammatory drug that is not a steroid. In addition to anti-inflammatory actions, non-steroidal anti-inflammatory drugs have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins.
anti-ulcer drug  One of various classes of drugs with different action mechanisms used to treat or ameliorate peptic ulcer or irritation of the gastrointestinal tract.
ChEBI Ontology
Outgoing Relation(s)
balsalazide (CHEBI:267413) has role anti-ulcer drug (CHEBI:49201)
balsalazide (CHEBI:267413) has role gastrointestinal drug (CHEBI:55324)
balsalazide (CHEBI:267413) has role non-steroidal anti-inflammatory drug (CHEBI:35475)
balsalazide (CHEBI:267413) has role prodrug (CHEBI:50266)
balsalazide (CHEBI:267413) is a monohydroxybenzoic acid (CHEBI:25389)
balsalazide (CHEBI:267413) is conjugate acid of balsalazide(2−) (CHEBI:59165)
Incoming Relation(s)
balsalazide disodium (CHEBI:59164) has functional parent balsalazide (CHEBI:267413)
balsalazide(2−) (CHEBI:59165) is conjugate base of balsalazide (CHEBI:267413)
IUPAC Name 
5-[(E)-{4-[(2-carboxyethyl)carbamoyl]phenyl}diazenyl]-2-hydroxybenzoic acid
INNs  Source
balsalazidaChemIDplus
balsalazideChemIDplus
balsalazidumChemIDplus
Synonyms  Source
3-(2-{4-[(2-carboxyethyl)carbamoyl]phenyl}hydrazinylidene)-6-oxocyclohexa-1,4-diene-1-carboxylic acidIUPAC
5-[4-(2-carboxy-ethylcarbamoyl)-phenylazo]-2-hydroxy-benzoic acidChEBI
balsalazidoChemIDplus
(E)-5-((4-(((2-carboxyethyl)amino)carbonyl)phenyl)azo)-2-hydroxybenzoic acidChemIDplus
(E)-5-({p-[(2-carboxyethyl)carbamoyl]phenyl}azo)-2-salicylic acidChEBI
Manual XrefsDatabases
284DrugCentral
BalsalazideWikipedia
D07488KEGG DRUG
DB01014DrugBank
GB2080796Patent
US4412992Patent
Registry NumbersSources
Reaxys:8081576Reaxys
CAS:80573-04-2ChemIDplus