EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:218465 - Kirkamide

ChEBI IDCHEBI:218465
ChEBI NameKirkamide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H15NO5
Net Charge0
Average Mass217.221
Monoisotopic Mass217.09502
SMILESCC(=O)N[C@@H]1[C@@H](O)[C@H](O)C(CO)=C[C@@H]1O
InChIInChI=1S/C9H15NO5/c1-4(12)10-7-6(13)2-5(3-11)8(14)9(7)15/h2,6-9,11,13-15H,3H2,1H3,(H,10,12)/t6-,7-,8+,9+/m0/s1
InChIKeyPLIJNXBKCPWNJD-RBXMUDONSA-N
Species of MetaboliteComponentSourceComments
Burkholderia (ncbitaxon:32008) - PubMed (26033226)
ChEBI Ontology
Outgoing Relation(s)
Kirkamide (CHEBI:218465) is a cyclitol (CHEBI:23451)
IUPAC Name 
N-[(1S,2S,5R,6R)-2,5,6-trihydroxy-4-(hydroxymethyl)cyclohex-3-en-1-yl]acetamide
Manual XrefsDatabases
35000176ChemSpider