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CHEBI:70509 - 20(R)-tubotaiwine

ChEBI IDCHEBI:70509
ChEBI Name20(R)-tubotaiwine
Stars
DefinitionA natural product found in Alstonia spatulata.
Last Modified22 September 2014
DownloadsMolfile
FormulaC20H24N2O2
Net Charge0
Average Mass324.424
Monoisotopic Mass324.18378
SMILES[H][C@]12[C@H](CC)[C@]3([H])CCN1CC[C@@]21C(=C3C(=O)OC)Nc2ccccc21
InChIInChI=1S/C20H24N2O2/c1-3-12-13-8-10-22-11-9-20(18(12)22)14-6-4-5-7-15(14)21-17(20)16(13)19(23)24-2/h4-7,12-13,18,21H,3,8-11H2,1-2H3/t12-,13+,18-,20-/m1/s1
InChIKeyRLAKWLFUMAABBE-NGVQZCTJSA-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 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)
20(R)-tubotaiwine (CHEBI:70509) has role metabolite (CHEBI:25212)
20(R)-tubotaiwine (CHEBI:70509) is a alkaloid (CHEBI:22315)
Citations