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CHEBI:14027 - corydaline

ChEBI IDCHEBI:14027
ChEBI Namecorydaline
Stars
Last Modified13 November 2017
DownloadsMolfile
FormulaC22H27NO4
Net Charge0
Average Mass369.461
Monoisotopic Mass369.19401
SMILES[H][C@@]12c3cc(OC)c(OC)cc3CCN1Cc1c(ccc(OC)c1OC)[C@@H]2C
InChIInChI=1S/C22H27NO4/c1-13-15-6-7-18(24-2)22(27-5)17(15)12-23-9-8-14-10-19(25-3)20(26-4)11-16(14)21(13)23/h6-7,10-11,13,21H,8-9,12H2,1-5H3/t13-,21+/m0/s1
InChIKeyVRSRXLJTYQVOHC-YEJXKQKISA-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)
corydaline (CHEBI:14027) is a isoquinoline alkaloid (CHEBI:24921)
corydaline (CHEBI:14027) is a isoquinolines (CHEBI:24922)
IUPAC Name 
2,3,9,10-tetramethoxy-13β-methyl-13aβ-berbine
Synonyms  Source
(13S,13aR)-2,3,9,10-tetramethoxy-13-methyl-5,8,13,13a-tetrahydro-6H-isoquino[3,2-a]isoquinolineIUPAC
(+)-CorydalineKEGG COMPOUND
UniProt Name  Source
corydalineUniProt
Manual XrefsDatabases
C00026115KNApSAcK
C15530KEGG COMPOUND
Registry NumbersSources
Beilstein:96972Beilstein
CAS:518-69-4ChemIDplus
CAS:518-69-4KEGG COMPOUND