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CHEBI:70512 - 19,20-E-vallesamine

ChEBI IDCHEBI:70512
ChEBI Name19,20-E-vallesamine
Stars
DefinitionA natural product found in Alstonia spatulata.
Last Modified22 September 2014
DownloadsMolfile
FormulaC20H24N2O3
Net Charge0
Average Mass340.423
Monoisotopic Mass340.17869
SMILES[H][C@]12CCN(C/C1=C/C)Cc1c(nc3ccccc13)[C@]2(CO)C(=O)OC
InChIInChI=1S/C20H24N2O3/c1-3-13-10-22-9-8-16(13)20(12-23,19(24)25-2)18-15(11-22)14-6-4-5-7-17(14)21-18/h3-7,16,21,23H,8-12H2,1-2H3/b13-3-/t16-,20+/m0/s1
InChIKeyJZKSIYFJGCTTET-DIYYJNGXSA-N
Species of MetaboliteComponentSourceComments
Alstonia spatulata (IPNI:76595-1) stem (BTO:0001300) PubMed (21043460) Previous component: stem bark; Extraction of stembark with concentrated EtOH with dilute acids
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
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)
19,20-E-vallesamine (CHEBI:70512) has role metabolite (CHEBI:25212)
19,20-E-vallesamine (CHEBI:70512) is a alkaloid (CHEBI:22315)
Citations