N(beta)-Epoxysuccinamoyl-diaminopropionyl-valine (CHEBI:190274)

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CHEBI:190274 - N(beta)-Epoxysuccinamoyl-diaminopropionyl-valine

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ChEBI ID	CHEBI:190274
ChEBI Name	N(beta)-Epoxysuccinamoyl-diaminopropionyl-valine
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C12H20N4O6
Net Charge	0
Average Mass	316.314
Monoisotopic Mass	316.13828
SMILES	CC(C)[C@H](NC(=O)[C@@H](N)CNC(=O)C1OC1C(N)=O)C(=O)O
InChI	InChI=1S/C12H20N4O6/c1-4(2)6(12(20)21)16-10(18)5(13)3-15-11(19)8-7(22-8)9(14)17/h4-8H,3,13H2,1-2H3,(H2,14,17)(H,15,19)(H,16,18)(H,20,21)/t5-,6-,7?,8?/m0/s1
InChIKey	HCGFOSJNUODEOH-LHZZQDSXSA-N

Species of Metabolite	Component	Source	Comments
Synechococcus elongatus PCC 7942 (ncbitaxon:32046)	cell culture (BTO:0000214)	MetaboLights (MTBLS2825)

Roles Classification

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	N(beta)-Epoxysuccinamoyl-diaminopropionyl-valine (CHEBI:190274) is a peptide (CHEBI:16670)

IUPAC Name
(2S)-2-[[(2S)-2-amino-3-[(3-carbamoyloxirane-2-carbonyl)amino]propanoyl]amino]-3-methylbutanoic acid

Manual Xrefs	Databases
C20965	KEGG COMPOUND