CHEBI:69418 - opacaline B

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ChEBI Name opacaline B
ChEBI ID CHEBI:69418
Definition A natural product found in Pseudodistoma opacum.
Stars This entity has been manually annotated by a third party.
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Download Molfile XML SDF
Formula C20H20BrF6N5O5
Net Charge 0
Average Mass 604.29800
Monoisotopic Mass 603.05520
InChI InChI=1S/C16H18BrN5O.2C2HF3O2/c17-10-4-5-11-12-6-8-20-13(3-1-2-7-21-16(18)19)15(12)22(23)14(11)9-10;2*3-2(4,5)1(6)7/h4-6,8-9,23H,1-3,7H2,(H4,18,19,21);2*(H,6,7)
InChIKey DUFSUOKKDGWMPR-UHFFFAOYSA-N
SMILES [O-]C(=O)C(F)(F)F.[O-]C(=O)C(F)(F)F.NC(=[NH2+])NCCCCc1[nH+]ccc2c3ccc(Br)cc3n(O)c12
Metabolite of Species Details
Pseudodistoma opacum (WORMS:251228) MeOH extract of frozen specimens See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing opacaline B (CHEBI:69418) has role metabolite (CHEBI:25212)
opacaline B (CHEBI:69418) is a organic molecular entity (CHEBI:50860)
Citation