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CHEBI:52160 - procaine(1+)

ChEBI IDCHEBI:52160
ChEBI Nameprocaine(1+)
Stars
DefinitionAn organic cation that is the monoprotonated form of procaine.
Last Modified5 December 2011
SubmitterMarcus Ennis
DownloadsMolfile
FormulaH.C13H20N2O2
Net Charge+1
Average Mass237.323
Monoisotopic Mass237.15975
SMILESCCN(CC)CCOC(=O)c1ccc(N)cc1.[H+]
InChIInChI=1S/C13H20N2O2/c1-3-15(4-2)9-10-17-13(16)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10,14H2,1-2H3/p+1
InChIKeyMFDFERRIHVXMIY-UHFFFAOYSA-O
ChEBI Ontology
Outgoing Relation(s)
procaine(1+) (CHEBI:52160) is a organic cation (CHEBI:25697)
procaine(1+) (CHEBI:52160) is conjugate acid of procaine (CHEBI:8430)
Incoming Relation(s)
procaine(1+) salt (CHEBI:52161) has part procaine(1+) (CHEBI:52160)
procaine (CHEBI:8430) is conjugate base of procaine(1+) (CHEBI:52160)
Synonym  Source
4-amino-benzoic acid 2-diethylammonio-ethyl ester monocationChEBI
Registry NumbersSources
Reaxys:3674525Reaxys