Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:69920 - JBIR-56
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
JBIR-56
ChEBI ID
CHEBI:69920
Definition
A natural product found in
Streptomyces
species.
Stars
This entity has been manually annotated by a third party.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C19H30N4O5
Net Charge
0
Average Mass
394.46530
Monoisotopic Mass
394.22162
InChI
InChI=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
InChIKey
XNVDHFYDNXAOFB-WCQYABFASA-N
SMILES
CCc1[nH]c(=O)c(nc1C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](C)C(O)=O)C(C)C
Metabolite of Species
Details
Streptomyces
sp.
(NCBI:txid1931)
Strain isolated from marine sponge of strain SpD081030SC 03 See:
PubMed
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
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
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-alanine
ChEBI
Citation
Type
Source
21728289
PubMed citation
Europe PMC
Last Modified
22 September 2014
General Comment
2014-10-17
Suggested Classification: ISA:N-acyl-amino acid(CHEBI:51569); ISA:amino acid amide(CHEBI:22475); ISA:alpha-amino acid(CHEBI:33704); ISA:pyrazines(CHEBI:38314); ISA:carboxamide(CHEBI:37622); ISA:aralkylamine(CHEBI:18000); ISA:fatty amide(CHEBI:29348); ISA:enol ether(CHEBI:47985); ISA:enone(CHEBI:51689); ISA:enamine(CHEBI:47989); ISA:lactam(CHEBI:24995); ISA:carboxylic acid(CHEBI:33575); ISA:organonitrogen compound(CHEBI:35352); ISA:monocarboxylic acid(CHEBI:25384); ISA:carbonyl compound(CHEBI:36586);