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CHEBI:2886 - Aspidodasycarpine

ChEBI IDCHEBI:2886
ChEBI NameAspidodasycarpine
Stars
Last Modified9 March 2018
DownloadsMolfile
FormulaC21H26N2O4
Net Charge0
Average Mass370.449
Monoisotopic Mass370.18926
SMILES[H][C@@]12C[C@@H](/C(=C\C)CN1)C(CO)(C(=O)OC)[C@@]13CCO[C@]12Nc1ccccc13
InChIInChI=1S/C21H26N2O4/c1-3-13-11-22-17-10-15(13)19(12-24,18(25)26-2)20-8-9-27-21(17,20)23-16-7-5-4-6-14(16)20/h3-7,15,17,22-24H,8-12H2,1-2H3/b13-3-/t15-,17-,19?,20-,21-/m0/s1
InChIKeyOQJSSGHGITUGKL-MEASUVLSSA-N
ChEBI Ontology
Outgoing Relation(s)
Aspidodasycarpine (CHEBI:2886) is a carbazoles (CHEBI:48513)
Aspidodasycarpine (CHEBI:2886) is a methyl ester (CHEBI:25248)
Synonym  Source
AspidodasycarpineKEGG COMPOUND
Manual XrefsDatabases
C09039KEGG COMPOUND
Registry NumbersSources
CAS:2744-47-0KEGG COMPOUND