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CHEBI:69392 - stemokerrine

Default Structure
ChEBI IDCHEBI:69392
ChEBI Namestemokerrine
Stars
DefinitionA natural product found in Stemona kerrii.
Last Modified22 September 2014
DownloadsMolfile
FormulaC22H31NO5
Net Charge0
Average Mass389.492
Monoisotopic Mass389.22022
SMILES[H][C@]1([C@H](O)CC)CCC[C@]2([H])N1CCC=C1O/C(=C3\OC(=O)C(C)=C3OC)[C@@H](C)[C@@]12[H]
InChIInChI=1S/C22H31NO5/c1-5-16(24)14-8-6-9-15-18-12(2)20(27-17(18)10-7-11-23(14)15)21-19(26-4)13(3)22(25)28-21/h10,12,14-16,18,24H,5-9,11H2,1-4H3/b21-20-/t12-,14+,15-,16+,18+/m0/s1
InChIKeyKLADGQYNEYECIT-LFVNKPDISA-N
Species of MetaboliteComponentSourceComments
Stemona kerrii (ncbitaxon:564062)
rhizome (BTO:0001181) PubMed (21902195) MeOH extract of dried underground parts(tuberous roots and rhizomes)
tuberous root (BTO:0001309) PubMed (21902195) MeOH extract of dried underground parts(tuberous roots and rhizomes)
root (BTO:0001188) PubMed (21049906)
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)
stemokerrine (CHEBI:69392) has role metabolite (CHEBI:25212)
stemokerrine (CHEBI:69392) is a citraconoyl group (CHEBI:23315)
Citations