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CHEBI:3916 - Crinasiatine

ChEBI IDCHEBI:3916
ChEBI NameCrinasiatine
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC22H17NO4
Net Charge0
Average Mass359.381
Monoisotopic Mass359.11576
SMILES[H]C1(Cc2ccc(O)cc2)COc2cc3c(cc2O1)c(=O)nc1ccccc13
InChIInChI=1S/C22H17NO4/c24-14-7-5-13(6-8-14)9-15-12-26-20-10-17-16-3-1-2-4-19(16)23-22(25)18(17)11-21(20)27-15/h1-8,10-11,15,24H,9,12H2,(H,23,25)
InChIKeyXFYYJHYSDXQMAE-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Crinasiatine (CHEBI:3916) is a phenanthridines (CHEBI:51245)
Synonym  Source
CrinasiatineKEGG COMPOUND
Manual XrefsDatabases
C10584KEGG COMPOUND
C00002329KNApSAcK
Registry NumbersSources
CAS:97682-69-4KEGG COMPOUND