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CHEBI:39458 - (+)-isopilocarpine

ChEBI IDCHEBI:39458
ChEBI Name(+)-isopilocarpine
Stars
Last Modified25 February 2016
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC11H16N2O2
Net Charge0
Average Mass208.261
Monoisotopic Mass208.12118
SMILESCC[C@H]1C(=O)OC[C@@H]1Cc1cncn1C
InChIInChI=1S/C11H16N2O2/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h5,7-8,10H,3-4,6H2,1-2H3/t8-,10+/m0/s1
InChIKeyQCHFTSOMWOSFHM-WCBMZHEXSA-N
ChEBI Ontology
Outgoing Relation(s)
(+)-isopilocarpine (CHEBI:39458) is a isopilocarpine (CHEBI:39459)
(+)-isopilocarpine (CHEBI:39458) is enantiomer of (−)-isopilocarpine (CHEBI:39461)
Incoming Relation(s)
(−)-isopilocarpine (CHEBI:39461) is enantiomer of (+)-isopilocarpine (CHEBI:39458)
IUPAC Name 
(3R,4R)-3-ethyl-4-[(1-methyl-1H-imidazol-5-yl)methyl]dihydrofuran-2(3H)-one
Synonyms  Source
β-pilocarpineChemIDplus
(+)-isopilocarpineChemIDplus
3-isopilocarpineChemIDplus
Manual XrefsDatabases
LSM-15522LINCS
Registry NumbersSources
Beilstein:86188Beilstein
CAS:531-35-1ChemIDplus