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CHEBI:8826 - Rhexifoline

Default Structure
ChEBI IDCHEBI:8826
ChEBI NameRhexifoline
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC11H13NO3
Net Charge0
Average Mass207.229
Monoisotopic Mass207.08954
SMILESCOC(=O)c1cncc2c1[C@H](O)C[C@H]2C
InChIInChI=1S/C11H13NO3/c1-6-3-9(13)10-7(6)4-12-5-8(10)11(14)15-2/h4-6,9,13H,3H2,1-2H3/t6-,9-/m1/s1
InChIKeySEQJFRYHSZPDOC-HZGVNTEJSA-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)
Rhexifoline (CHEBI:8826) is a aromatic carboxylic acid (CHEBI:33859)
Rhexifoline (CHEBI:8826) is a pyridines (CHEBI:26421)
Synonym  Source
RhexifolineKEGG COMPOUND
Manual XrefsDatabases
C00001981KNApSAcK
C09986KEGG COMPOUND
Registry NumbersSources
CAS:93915-32-3KEGG COMPOUND