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CHEBI:70635 - (7S,14S)-(-)-7-Methyl-10-O-demethylxylopinine

ChEBI IDCHEBI:70635
ChEBI Name(7S,14S)-(-)-7-Methyl-10-O-demethylxylopinine
Stars
DefinitionA natural product found in Annona glabra.
Last Modified22 September 2014
DownloadsMolfile
FormulaC21H26NO4
Net Charge+1
Average Mass356.442
Monoisotopic Mass356.18563
SMILES[H][C@@]12Cc3cc(OC)c(O)cc3C[N@+]1(C)CCc1cc(OC)c(OC)cc12
InChIInChI=1S/C21H25NO4/c1-22-6-5-13-9-20(25-3)21(26-4)11-16(13)17(22)7-14-10-19(24-2)18(23)8-15(14)12-22/h8-11,17H,5-7,12H2,1-4H3/p+1/t17-,22-/m0/s1
InChIKeyRSXDOESUHFUNSO-JTSKRJEESA-O
Species of MetaboliteComponentSourceComments
Annona glabra (ncbitaxon:301703) stem wood (BTO:0001469) DOI (10.1021/np100247r) Ethanolic extract of stemwood
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)
(7S,14S)-(-)-7-Methyl-10-O-demethylxylopinine (CHEBI:70635) has role metabolite (CHEBI:25212)
(7S,14S)-(-)-7-Methyl-10-O-demethylxylopinine (CHEBI:70635) is a alkaloid (CHEBI:22315)
Synonym  Source
(-)-(7S,13aS)-2,3,11-trimethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-10-olChEBI