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CHEBI:5316 - Gentianamine

ChEBI IDCHEBI:5316
ChEBI NameGentianamine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC11H11NO3
Net Charge0
Average Mass205.213
Monoisotopic Mass205.07389
SMILESC=Cc1cncc2c1C(CO)COC2=O
InChIInChI=1S/C11H11NO3/c1-2-7-3-12-4-9-10(7)8(5-13)6-15-11(9)14/h2-4,8,13H,1,5-6H2
InChIKeyPGWRAJMYNMYBFM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Gentianamine (CHEBI:5316) is a pyranopyridine (CHEBI:38192)
Synonym  Source
GentianamineKEGG COMPOUND
Manual XrefsDatabases
C09961KEGG COMPOUND
C00001976KNApSAcK
Registry NumbersSources
CAS:22952-54-1KEGG COMPOUND