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CHEBI:165180 - Calystegine C1

ChEBI IDCHEBI:165180
ChEBI NameCalystegine C1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC7H13NO5
Net Charge0
Average Mass191.183
Monoisotopic Mass191.07937
SMILESOC1CC2(O)NC1C(O)C(O)C2O
InChIInChI=1S/C7H13NO5/c9-2-1-7(13)6(12)5(11)4(10)3(2)8-7/h2-6,8-13H,1H2
InChIKeyGGOJRYWHKVYFQK-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Calystegine C1 (CHEBI:165180) is a tropane alkaloid (CHEBI:37332)
IUPAC Name 
8-azabicyclo[3.2.1]octane-1,2,3,4,6-pentol
Manual XrefsDatabases
341829ChemSpider
HMDB0031346HMDB