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CHEBI:230914 - 3h-Adrenaline

ChEBI IDCHEBI:230914
ChEBI Name3h-Adrenaline
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H15NO3
Net Charge0
Average Mass185.223
Monoisotopic Mass185.10519
SMILESCNCC(O)C1=CC=C(O)C(O)C1
InChIInChI=1S/C9H15NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-3,8-13H,4-5H2,1H3
InChIKeyRKMGZICTHQMBTN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS9100)
ChEBI Ontology
Outgoing Relation(s)
3h-Adrenaline (CHEBI:230914) is a secondary alcohol (CHEBI:35681)
IUPAC Name 
5-[1-hydroxy-2-(methylamino)ethyl]cyclohexa-2,4-diene-1,2-diol
Manual XrefsDatabases
HMDB0246263HMDB
66424646ChemSpider