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CHEBI:188882 - (+)-Lythrine

ChEBI IDCHEBI:188882
ChEBI Name(+)-Lythrine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H29NO5
Net Charge0
Average Mass435.520
Monoisotopic Mass435.20457
SMILES[H][C@]12C[C@]3([H])CCCCN3[C@@]([H])(C1)c1cc(OC)c(OC)cc1-c1cc(ccc1O)/C=C\C(=O)O2
InChIInChI=1S/C26H29NO5/c1-30-24-14-19-20(15-25(24)31-2)22-13-18(12-17-5-3-4-10-27(17)22)32-26(29)9-7-16-6-8-23(28)21(19)11-16/h6-9,11,14-15,17-18,22,28H,3-5,10,12-13H2,1-2H3/b9-7-/t17-,18-,22-/m0/s1
InChIKeyWCZWUYYJZVBKDZ-ZQMQQCDVSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
(+)-Lythrine (CHEBI:188882) is a quinolizidines (CHEBI:26516)
IUPAC Name 
(1S,13Z,17S,19S)-9-hydroxy-4,5-dimethoxy-16-oxa-24-azapentacyclo[15.7.1.18,12.02,7.019,24]hexacosa-2,4,6,8,10,12(26),13-heptaen-15-one
Manual XrefsDatabases
4945484ChemSpider
Registry NumbersSources
CAS:5286-10-2ChemIDplus