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CHEBI:229156 - Lythrancepine I

ChEBI IDCHEBI:229156
ChEBI NameLythrancepine I
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H35NO4
Net Charge0
Average Mass437.580
Monoisotopic Mass437.25661
SMILESCOc1ccc2cc1-c1cc(ccc1OC)C1CC(O)CC3CCCC(CC(O)CC2)N31
InChIInChI=1S/C27H35NO4/c1-31-26-10-7-17-6-9-21(29)14-19-4-3-5-20-15-22(30)16-25(28(19)20)18-8-11-27(32-2)24(13-18)23(26)12-17/h7-8,10-13,19-22,25,29-30H,3-6,9,14-16H2,1-2H3
InChIKeyVGYYIDCLTXFNGW-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
Lythrancepine I (CHEBI:229156) is a quinolizidines (CHEBI:26516)
IUPAC Name 
5,8-dimethoxy-24-azapentacyclo[14.7.1.12,6.17,11.020,24]hexacosa-2(26),3,5,7,9,11(25)-hexaene-14,22-diol
Manual XrefsDatabases
4477516ChemSpider