CHEBI:132661 - isostrychnine N-oxide

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ChEBI Name isostrychnine N-oxide
ChEBI ID CHEBI:132661
ChEBI ASCII Name isostrychnine N-oxide
Definition A monoterpenoid indole alkaloid with formula C21H22N2O3, originally isolated from the seeds of Strychnos nux-vomica.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter qingping liu
Supplier Information
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Formula C21H22N2O3
Net Charge 0
Average Mass 350.412
Monoisotopic Mass 350.16304
InChI InChI=1S/C21H22N2O3/c24-10-7-13-12-23(26)9-8-21-16-3-1-2-4-17(16)22-19(25)6-5-14(20(21)22)15(13)11-18(21)23/h1-5,7,15,18,20,24H,6,8-12H2/b13-7-/t15-,18-,20-,21+,23?/m0/s1
InChIKey JSOOHERMGHRAQI-WMJCWLERSA-N
SMILES O=C1N2[C@@]3([C@@]4([C@]5([N+](CC4)(C\C(\[C@](C5)(C3=CC1)[H])=C\CO)[O-])[H])C=6C2=CC=CC6)[H]
Metabolite of Species Details
Strychnos nux-vomica (NCBI:txid28545) Found in seed (BTO:0001226). See: PubMed
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing isostrychnine N-oxide (CHEBI:132661) has role plant metabolite (CHEBI:76924)
isostrychnine N-oxide (CHEBI:132661) is a δ-lactam (CHEBI:77727)
isostrychnine N-oxide (CHEBI:132661) is a monoterpenoid indole alkaloid (CHEBI:65323)
isostrychnine N-oxide (CHEBI:132661) is a olefinic compound (CHEBI:78840)
isostrychnine N-oxide (CHEBI:132661) is a organic heterohexacyclic compound (CHEBI:51914)
isostrychnine N-oxide (CHEBI:132661) is a primary alcohol (CHEBI:15734)
isostrychnine N-oxide (CHEBI:132661) is a tertiary amine oxide (CHEBI:134363)
IUPAC Name
(3aS,11bS,12S,13aS,14E)-14-(2-hydroxyethylidene)-1-oxo-1,2,3,10,11b,12,13,13a-octahydro-9H-1,12-ethano-1λ5-pyrido[1,2,3-lm]pyrrolo[2,3-d]carbazol-9-one
Registry Number Type Source
26576610 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
7912074 PubMed citation Europe PMC
Last Modified
01 February 2017