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CHEBI:2688 - Amurensine

ChEBI IDCHEBI:2688
ChEBI NameAmurensine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC19H19NO4
Net Charge0
Average Mass325.364
Monoisotopic Mass325.13141
SMILESCOc1cc2c(cc1O)[C@H]1CN(C)[C@@H](C2)c2cc3c(cc21)OCO3
InChIInChI=1S/C19H19NO4/c1-20-8-14-11-5-16(21)17(22-2)4-10(11)3-15(20)13-7-19-18(6-12(13)14)23-9-24-19/h4-7,14-15,21H,3,8-9H2,1-2H3/t14-,15+/m1/s1
InChIKeyBXWVSGUITWLTOD-CABCVRRESA-N
ChEBI Ontology
Outgoing Relation(s)
Amurensine (CHEBI:2688) is a isoquinolines (CHEBI:24922)
Synonym  Source
AmurensineKEGG COMPOUND
Manual XrefsDatabases
C09333KEGG COMPOUND
C00001801KNApSAcK
Registry NumbersSources
CAS:10481-92-2KEGG COMPOUND