Dapdiamide D (CHEBI:204720)

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CHEBI:204720 - Dapdiamide D

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ChEBI ID	CHEBI:204720
ChEBI Name	Dapdiamide D
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C12H20N4O5
Net Charge	0
Average Mass	300.315
Monoisotopic Mass	300.14337
SMILES	CC(C)[C@H](NC(=O)[C@H](CN)NC(=O)/C=C/C(N)=O)C(=O)O
InChI	InChI=1S/C12H20N4O5/c1-6(2)10(12(20)21)16-11(19)7(5-13)15-9(18)4-3-8(14)17/h3-4,6-7,10H,5,13H2,1-2H3,(H2,14,17)(H,15,18)(H,16,19)(H,20,21)/b4-3+/t7-,10-/m0/s1
InChIKey	IRWJJINNIZZEIB-BRUQVKLWSA-N

Species of Metabolite	Component	Source	Comments
Pantoea agglomerans (ncbitaxon:549)	-	PubMed (20041689)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Dapdiamide D (CHEBI:204720) is a dipeptide (CHEBI:46761)

IUPAC Name
(2S)-2-[[(2S)-3-amino-2-[[(E)-4-amino-4-oxobut-2-enoyl]amino]propanoyl]amino]-3-methylbutanoic acid

Manual Xrefs	Databases
58837248	ChemSpider