EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:173864 - 4,6,7-Trihydroxy-1,2,3,4-tetrahydroisoquinoline

ChEBI IDCHEBI:173864
ChEBI Name4,6,7-Trihydroxy-1,2,3,4-tetrahydroisoquinoline
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H11NO3
Net Charge0
Average Mass181.191
Monoisotopic Mass181.07389
SMILESOc1cc2c(cc1O)C(O)CNC2
InChIInChI=1S/C9H11NO3/c11-7-1-5-3-10-4-9(13)6(5)2-8(7)12/h1-2,9-13H,3-4H2
InChIKeyRNIMUEXSLJYHIE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4,6,7-Trihydroxy-1,2,3,4-tetrahydroisoquinoline (CHEBI:173864) is a isoquinolines (CHEBI:24922)
IUPAC Name 
1,2,3,4-tetrahydroisoquinoline-4,6,7-triol
Manual XrefsDatabases
HMDB0060280HMDB
2284248ChemSpider
Registry NumbersSources
CAS:50988-14-2ChemIDplus