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CHEBI:68991 - capnoidine

Default Structure
ChEBI IDCHEBI:68991
ChEBI Namecapnoidine
Stars
Secondary ChEBI IDCHEBI:3370
Last Modified28 July 2014
DownloadsMolfile
FormulaC20H17NO6
Net Charge0
Average Mass367.357
Monoisotopic Mass367.10559
SMILES[H][C@]1([C@]2([H])OC(=O)c3c2ccc2c3OCO2)c2cc3c(cc2CCN1C)OCO3
InChIInChI=1S/C20H17NO6/c1-21-5-4-10-6-14-15(25-8-24-14)7-12(10)17(21)18-11-2-3-13-19(26-9-23-13)16(11)20(22)27-18/h2-3,6-7,17-18H,4-5,8-9H2,1H3/t17-,18-/m1/s1
InChIKeyIYGYMKDQCDOMRE-QZTJIDSGSA-N
Species of MetaboliteComponentSourceComments
Corydalis cava (IPNI:672129-1) - PubMed (22029392)
Corydalis sempervirens (ncbitaxon:3464) - PubMed (22029392)
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)
capnoidine (CHEBI:68991) has role metabolite (CHEBI:25212)
capnoidine (CHEBI:68991) is a organic molecular entity (CHEBI:50860)
Synonyms  Source
(-)-AdlumidineKEGG COMPOUND
(-)-AdlumidineChEBI
CapnoidineKEGG COMPOUND
Furo(3,4-e)-1,3-benzodioxol-8(6H)-one, 6-(5,6,7,8-tetrahydro-6-methyl-1,3-dioxolo(4,5-g)isoquinolin-5-yl)-,(R,R)-ChEBI
Manual XrefsDatabases
C00001830KNApSAcK
C09372KEGG COMPOUND
Registry NumbersSources
CAS:485-50-7KEGG COMPOUND
CAS:485-50-7ChemIDplus
Citations