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CHEBI:70506 - undulifoline

ChEBI IDCHEBI:70506
ChEBI Nameundulifoline
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)[C@@]3([H])c4c(nc5ccccc45)[C@]1(C(=O)OC)COCC[C@@]23[H]
InChIInChI=1S/C20H24N2O3/c1-22-9-7-14-12-8-10-25-11-20(14,19(23)24-2)18-16(17(12)22)13-5-3-4-6-15(13)21-18/h3-6,12,14,17,21H,7-11H2,1-2H3/t12-,14-,17+,20-/m0/s1
InChIKeyITRBOGBMPGNZBO-AJRGADBESA-N
Species of MetaboliteComponentSourceComments
Alstonia spatulata (IPNI:76595-1)
leaf (BTO:0000713) PubMed (21043460) Extraction of leaves and stem bark with concentrated EtOH with dilute acids
stem (BTO:0001300) PubMed (21043460) Previous component: stem bark; Extraction of leaves and stem bark with concentrated EtOH with dilute acids
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)
undulifoline (CHEBI:70506) has role metabolite (CHEBI:25212)
undulifoline (CHEBI:70506) is a carbazoles (CHEBI:48513)
Synonym  Source
methyl(1S,6S,7R,16S)-13-methyl-5,6,7,12-tetrahydro-2H-7,1,6-(epiminopropane[1,3,3]triyl)oxonino[4,5-b]indole-1(4H)-carboxylateChEBI
Citations