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CHEBI:87460 - 6-hydroxy-N-methylmyosmine

ChEBI IDCHEBI:87460
ChEBI Name6-hydroxy-N-methylmyosmine
Stars
ASCII Name6-hydroxy-N-methylmyosmine
DefinitionA member of the class of pyrrolines that is N-methyl-2-pyrroline carrying a 6-hydroxypyridin-3-yl substituent at position 2.
Secondary ChEBI IDCHEBI:87164
Last Modified12 August 2015
SubmitterKristian Axelsen, Steve
DownloadsMolfile
FormulaC10H13N2O
Net Charge+1
Average Mass177.227
Monoisotopic Mass177.10224
SMILESC[N+]1=C(c2ccc(O)nc2)CCC1
InChIInChI=1S/C10H12N2O/c1-12-6-2-3-9(12)8-4-5-10(13)11-7-8/h4-5,7H,2-3,6H2,1H3/p+1
InChIKeyOPKBIPWQEOKATF-UHFFFAOYSA-O
Species of MetaboliteComponentSourceComments
Pseudomonas geniculata (ncbitaxon:1167641)
- PubMed (24416227) Strain: N1
- PubMed (24416227) Strain: N1
Ochrobactrum sp. (ncbitaxon:42190)
- PubMed (25344232) Strain: SJY1
- PubMed (25344232) Strain: SJY1
Agrobacterium tumefaciens (ncbitaxon:358)
- PubMed (22466953) Strain: S33
- PubMed (22466953) Strain: S33
Roles Classification
Biological Role:
bacterial xenobiotic metabolite  Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria.
ChEBI Ontology
Outgoing Relation(s)
6-hydroxy-N-methylmyosmine (CHEBI:87460) has role bacterial xenobiotic metabolite (CHEBI:76976)
6-hydroxy-N-methylmyosmine (CHEBI:87460) is a ammonium ion derivative (CHEBI:35274)
6-hydroxy-N-methylmyosmine (CHEBI:87460) is a monohydroxypyridine (CHEBI:38182)
6-hydroxy-N-methylmyosmine (CHEBI:87460) is a organic cation (CHEBI:25697)
6-hydroxy-N-methylmyosmine (CHEBI:87460) is a pyrroline (CHEBI:23763)
IUPAC Name 
5-(6-hydroxypyridin-3-yl)-1-methyl-3,4-dihydro-2H-pyrrolium
UniProt Name  Source
6-hydroxy-N-methylmyosmineUniProt
Manual XrefsDatabases
CPD-14077MetaCyc
Registry NumbersSources
Reaxys:27655163Reaxys
Citations