CHEBI:85333 - dapdiamide C

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ChEBI Name dapdiamide C
ChEBI ID CHEBI:85333
Definition A member of the family of dapdiamides consisting of alanylleucine, in which one of the methyl hydrogens of alanine is replaced by a fumaramoyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C13H22N4O5
Net Charge 0
Average Mass 314.33760
Monoisotopic Mass 314.15902
InChI InChI=1S/C13H22N4O5/c1-7(2)5-9(13(21)22)17-12(20)8(14)6-16-11(19)4-3-10(15)18/h3-4,7-9H,5-6,14H2,1-2H3,(H2,15,18)(H,16,19)(H,17,20)(H,21,22)/b4-3+/t8-,9-/m0/s1
InChIKey MJPKMDAPFRGJGV-FBFNWGNUSA-N
SMILES CC(C)C[C@H](NC(=O)[C@@H](N)CNC(=O)\C=C\C(N)=O)C(O)=O
Metabolite of Species Details
Pantoea agglomerans (NCBI:txid549) of strain CU0119 See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
(via dapdiamide )
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via dapdiamide )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing dapdiamide C (CHEBI:85333) is a dapdiamide (CHEBI:85331)
dapdiamide C (CHEBI:85333) is a enamide (CHEBI:51751)
dapdiamide C (CHEBI:85333) is a primary carboxamide (CHEBI:140324)
dapdiamide C (CHEBI:85333) is a secondary carboxamide (CHEBI:140325)
dapdiamide C (CHEBI:85333) is tautomer of dapdiamide C zwitterion (CHEBI:84322)
Incoming dapdiamide C zwitterion (CHEBI:84322) is tautomer of dapdiamide C (CHEBI:85333)
IUPAC Name
3-{[(2E)-4-amino-4-oxobut-2-enoyl]amino}-L-alanyl-L-leucine
Manual Xref Database
CPD-17541 MetaCyc
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Citations Waiting for Citations Types Sources
19807062 PubMed citation Europe PMC
20041689 PubMed citation Europe PMC
Last Modified
07 March 2018