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CHEBI:203112 - Cyclopiamide C

ChEBI IDCHEBI:203112
ChEBI NameCyclopiamide C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H18N2O4
Net Charge0
Average Mass338.363
Monoisotopic Mass338.12666
SMILESC[C@@H](CC(=O)O)N1C(=O)c2c(cc3cccc4c3c2C(=O)N4)C1(C)C
InChIInChI=1S/C19H18N2O4/c1-9(7-13(22)23)21-18(25)15-11(19(21,2)3)8-10-5-4-6-12-14(10)16(15)17(24)20-12/h4-6,8-9H,7H2,1-3H3,(H,20,24)(H,22,23)/t9-/m0/s1
InChIKeyNQSCTEKDHQYWCZ-VIFPVBQESA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - DOI (10.1016/j.tet.2014.12.031)
ChEBI Ontology
Outgoing Relation(s)
Cyclopiamide C (CHEBI:203112) is a isoindoles (CHEBI:24897)
IUPAC Name 
3-(5,5-dimethyl-3,14-dioxo-4,13-diazatetracyclo[6.6.1.02,6.012,15]pentadeca-1(15),2(6),7,9,11-pentaen-4-yl)butanoic acid
Manual XrefsDatabases
35516785ChemSpider