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CHEBI:3925 - Crotanecine

Default Structure
ChEBI IDCHEBI:3925
ChEBI NameCrotanecine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC8H13NO3
Net Charge0
Average Mass171.196
Monoisotopic Mass171.08954
SMILES[H][C@]12C(CO)=CCN1C[C@@H](O)[C@H]2O
InChIInChI=1S/C8H13NO3/c10-4-5-1-2-9-3-6(11)8(12)7(5)9/h1,6-8,10-12H,2-4H2/t6-,7-,8-/m1/s1
InChIKeyVMWCRDCGNVMCGJ-BWZBUEFSSA-N
ChEBI Ontology
Outgoing Relation(s)
Crotanecine (CHEBI:3925) is a pyrrolizines (CHEBI:38522)
Synonym  Source
CrotanecineKEGG COMPOUND
Manual XrefsDatabases
C00002083KNApSAcK
C10284KEGG COMPOUND
Registry NumbersSources
CAS:5096-50-4KEGG COMPOUND