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CHEBI:174971 - Launobine

ChEBI IDCHEBI:174971
ChEBI NameLaunobine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H17NO4
Net Charge0
Average Mass311.337
Monoisotopic Mass311.11576
SMILES[H][C@]12Cc3ccc(OC)c(O)c3-c3c4c(cc(c31)CCN2)OCO4
InChIInChI=1S/C18H17NO4/c1-21-12-3-2-9-6-11-14-10(4-5-19-11)7-13-18(23-8-22-13)16(14)15(9)17(12)20/h2-3,7,11,19-20H,4-6,8H2,1H3/t11-/m0/s1
InChIKeyJIFBCUOVFPCZEW-NSHDSACASA-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)
Launobine (CHEBI:174971) is a isoquinoline alkaloid (CHEBI:24921)
IUPAC Name 
(12S)-17-methoxy-3,5-dioxa-11-azapentacyclo[10.7.1.02,6.08,20.014,19]icosa-1(20),2(6),7,14(19),15,17-hexaen-18-ol
Manual XrefsDatabases
154253ChemSpider
Registry NumbersSources
CAS:20497-21-6ChemIDplus