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CHEBI:10083 - Xylopine

ChEBI IDCHEBI:10083
ChEBI NameXylopine
Stars
Last Modified4 January 2017
DownloadsMolfile
FormulaC18H17NO3
Net Charge0
Average Mass295.338
Monoisotopic Mass295.12084
SMILES[H][C@@]12Cc3cc(OC)ccc3-c3c4c(cc(c31)CCN2)OCO4
InChIInChI=1S/C18H17NO3/c1-20-12-2-3-13-11(6-12)7-14-16-10(4-5-19-14)8-15-18(17(13)16)22-9-21-15/h2-3,6,8,14,19H,4-5,7,9H2,1H3/t14-/m1/s1
InChIKeyRFWCCZDSXIZJMF-CQSZACIVSA-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)
Xylopine (CHEBI:10083) is a aporphine alkaloid (CHEBI:134209)
Synonym  Source
XylopineKEGG COMPOUND
Manual XrefsDatabases
C09670KEGG COMPOUND
C00001928KNApSAcK
Registry NumbersSources
CAS:517-71-5KEGG COMPOUND