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CHEBI:84369 - cladoniamide D

ChEBI IDCHEBI:84369
ChEBI Namecladoniamide D
Stars
DefinitionAn organic heteropentacyclic compound that is cladoniamide E in which the chlorine attached to the methoxy-bearing indole moiety is replaced by a hydrogen. It has been isolated from the culture broth of Streptomyces uncialis.
Last Modified7 March 2018
SubmitterGareth Owen
DownloadsMolfile
FormulaC21H16ClN3O4
Net Charge0
Average Mass409.829
Monoisotopic Mass409.08293
SMILESCNC(=O)[C@]1(O)C(=O)c2c(nc3ccc(Cl)cc23)-c2c(OC)c3ccccc3n21
InChIInChI=1S/C21H16ClN3O4/c1-23-20(27)21(28)19(26)15-12-9-10(22)7-8-13(12)24-16(15)17-18(29-2)11-5-3-4-6-14(11)25(17)21/h3-9,24,28H,1-2H3,(H,23,27)/t21-/m1/s1
InChIKeyDAWUJAMYFBLITO-OAQYLSRUSA-N
Species of MetaboliteComponentSourceComments
Streptomyces uncialis (ncbitaxon:1048205) - PubMed (18646774)
Roles Classification
Biological Roles:
fungal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
cladoniamide D (CHEBI:84369) is a cladoniamide (CHEBI:83956)
cladoniamide D (CHEBI:84369) is a organic heteropentacyclic compound (CHEBI:38164)
cladoniamide D (CHEBI:84369) is a organochlorine compound (CHEBI:36683)
cladoniamide D (CHEBI:84369) is a secondary carboxamide (CHEBI:140325)
cladoniamide D (CHEBI:84369) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
(6R)-9-chloro-6-hydroxy-13-methoxy-N-methyl-7-oxo-7,12-dihydro-6H-pyrido[1,2-a:3,4-b']diindole-6-carboxamide
Registry NumbersSources
Reaxys:19021250Reaxys
Citations