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CHEBI:31033 - (R,S)-Scoulerine

ChEBI IDCHEBI:31033
ChEBI Name(R,S)-Scoulerine
Stars
Last Modified25 February 2016
DownloadsMolfile
FormulaC19H21NO4
Net Charge0
Average Mass327.380
Monoisotopic Mass327.14706
SMILESCOc1cc2c(cc1O)C1Cc3ccc(OC)c(O)c3CN1CC2
InChIInChI=1S/C19H21NO4/c1-23-17-4-3-11-7-15-13-9-16(21)18(24-2)8-12(13)5-6-20(15)10-14(11)19(17)22/h3-4,8-9,15,21-22H,5-7,10H2,1-2H3
InChIKeyKNWVMRVOBAFFMH-UHFFFAOYSA-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)
(R,S)-Scoulerine (CHEBI:31033) is a alkaloid (CHEBI:22315)
Synonyms  Source
(R,S)-ScoulerineKEGG COMPOUND
ScoulerineKEGG COMPOUND
Manual XrefsDatabases
C12326KEGG COMPOUND
LSM-6499LINCS
Registry NumbersSources
CAS:605-34-5KEGG COMPOUND
CAS:6451-72-5KEGG COMPOUND