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CHEBI:69920 - JBIR-56

Default Structure
ChEBI IDCHEBI:69920
ChEBI NameJBIR-56
Stars
DefinitionA natural product found in Streptomyces species.
Last Modified22 September 2014
DownloadsMolfile
FormulaC19H30N4O5
Net Charge0
Average Mass394.472
Monoisotopic Mass394.22162
SMILESCCc1nc(=O)c(C(C)C)nc1C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)C(=O)O
InChIInChI=1S/C19H30N4O5/c1-7-12-15(23-14(10(4)5)17(25)21-12)18(26)22-13(8-9(2)3)16(24)20-11(6)19(27)28/h9-11,13H,7-8H2,1-6H3,(H,20,24)(H,21,25)(H,22,26)(H,27,28)/t11-,13+/m0/s1
InChIKeyXNVDHFYDNXAOFB-WCQYABFASA-N
Species of MetaboliteComponentSourceComments
Streptomyces sp. (ncbitaxon:1931) - PubMed (21728289) Strain isolated from marine sponge Strain: SpD081030SC 03
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
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)
JBIR-56 (CHEBI:69920) has role metabolite (CHEBI:25212)
JBIR-56 (CHEBI:69920) is a peptide (CHEBI:16670)
Synonym  Source
N-[(3-Ethyl-6-isopropyl-5-oxo-4,5-dihydro-2-pyrazinyl)carbonyl]-D-leucyl-L-alanineChEBI
Citations