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CHEBI:141960 - Tubotaiwine

Default Structure
ChEBI IDCHEBI:141960
ChEBI NameTubotaiwine
Stars
Last Modified3 September 2018
Submittermwilliams
DownloadsMolfile
FormulaC20H24N2O2
Net Charge0
Average Mass324.424
Monoisotopic Mass324.18378
SMILES[H][C@]12N3CCC(C(C(=O)OC)=C4Nc5ccccc5[C@]41CC3)[C@]2([H])CC
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+/m0/s1
InChIKeyRLAKWLFUMAABBE-BMWAJPDPSA-N
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)
Tubotaiwine (CHEBI:141960) is a monoterpenoid indole alkaloid (CHEBI:65323)