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CHEBI:69419 - opacaline C

Default Structure
ChEBI IDCHEBI:69419
ChEBI Nameopacaline C
Stars
DefinitionA natural product found in Pseudodistoma opacum.
DownloadsMolfile
FormulaC15H18BrN5.2C2F3O2
Net Charge0
Average Mass574.276
Monoisotopic Mass573.04464
SMILESNC(=[NH2+])NCCCc1[nH+]ccc2c1nc1cc(Br)ccc12.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F
InChIInChI=1S/C15H16BrN5.2C2HF3O2/c16-9-3-4-10-11-5-7-19-12(2-1-6-20-15(17)18)14(11)21-13(10)8-9;2*3-2(4,5)1(6)7/h3-5,7-8,21H,1-2,6H2,(H4,17,18,20);2*(H,6,7)
InChIKeyRYOYDUHMAPUGGS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pseudodistoma opacum (WORMS:251228) - PubMed (21846091) MeOH extract of frozen specimens
Roles Classification
Biological Role:
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)
opacaline C (CHEBI:69419) has role metabolite (CHEBI:25212)
opacaline C (CHEBI:69419) is a organic molecular entity (CHEBI:50860)
Citations