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CHEBI:8303 - Polycarpine

ChEBI IDCHEBI:8303
ChEBI NamePolycarpine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC21H23NO6
Net Charge0
Average Mass385.416
Monoisotopic Mass385.15254
SMILESCOc1cc2c(cc1OC)/C(=C/c1ccc(OC)c(OC)c1O)N(C=O)CC2
InChIInChI=1S/C21H23NO6/c1-25-17-6-5-14(20(24)21(17)28-4)9-16-15-11-19(27-3)18(26-2)10-13(15)7-8-22(16)12-23/h5-6,9-12,24H,7-8H2,1-4H3/b16-9-
InChIKeyYYHGQOLZRYICRS-SXGWCWSVSA-N
ChEBI Ontology
Outgoing Relation(s)
Polycarpine (CHEBI:8303) is a isoquinolines (CHEBI:24922)
Synonym  Source
PolycarpineKEGG COMPOUND
Manual XrefsDatabases
C09610KEGG COMPOUND
C00001904KNApSAcK
Registry NumbersSources
CAS:63490-92-6KEGG COMPOUND