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CHEBI:125204 - 4-guanidinobenzoic acid

ChEBI IDCHEBI:125204
ChEBI Name4-guanidinobenzoic acid
Stars
DefinitionBenzoic acid substituted at the para position by a guanidino group.
Secondary ChEBI IDCHEBI:42695
Last Modified13 April 2021
DownloadsMolfile
FormulaC8H9N3O2
Net Charge0
Average Mass179.179
Monoisotopic Mass179.06948
SMILESN=C(N)Nc1ccc(C(=O)O)cc1
InChIInChI=1S/C8H9N3O2/c9-8(10)11-6-3-1-5(2-4-6)7(12)13/h1-4H,(H,12,13)(H4,9,10,11)
InChIKeySXTSBZBQQRIYCU-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
4-guanidinobenzoic acid (CHEBI:125204) is a benzoic acids (CHEBI:22723)
4-guanidinobenzoic acid (CHEBI:125204) is a guanidines (CHEBI:24436)
Incoming Relation(s)
camostat (CHEBI:135632) has functional parent 4-guanidinobenzoic acid (CHEBI:125204)
IUPAC Name 
4-carbamimidamidobenzoic acid
Synonyms  Source
4-Guanidino-benzoic acidChEMBL
p-guanidinobenzoic acidChEBI
Manual XrefsDatabases
GBSPDBeChem
DB02459DrugBank
JP2004284982Patent
Registry NumbersSources
Reaxys:2369015Reaxys
CAS:16060-65-4ChemIDplus
Citations