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CHEBI:2783 - Apodine

ChEBI IDCHEBI:2783
ChEBI NameApodine
Stars
Last Modified9 March 2018
DownloadsMolfile
FormulaC21H22N2O4
Net Charge0
Average Mass366.417
Monoisotopic Mass366.15796
SMILES[H][C@]12N3CC[C@]4([H])OC(=O)C[C@]14CC(C(=O)OC)=C1Nc4ccccc4[C@@]12CC3
InChIInChI=1S/C21H22N2O4/c1-26-18(25)12-10-20-11-16(24)27-15(20)6-8-23-9-7-21(19(20)23)13-4-2-3-5-14(13)22-17(12)21/h2-5,15,19,22H,6-11H2,1H3/t15-,19-,20-,21-/m0/s1
InChIKeySXLKMYFJLWDXFU-ZEWNOJEFSA-N
ChEBI Ontology
Outgoing Relation(s)
Apodine (CHEBI:2783) is a carbazoles (CHEBI:48513)
Apodine (CHEBI:2783) is a methyl ester (CHEBI:25248)
Synonym  Source
ApodineKEGG COMPOUND
Manual XrefsDatabases
C09034KEGG COMPOUND
C00001687KNApSAcK
Registry NumbersSources
CAS:57932-86-2KEGG COMPOUND