Malonomicin (CHEBI:218407)

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CHEBI:218407 - Malonomicin

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ChEBI ID	CHEBI:218407
ChEBI Name	Malonomicin
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C13H18N4O9
Net Charge	0
Average Mass	374.306
Monoisotopic Mass	374.10738
SMILES	NCC1NC(=O)C(C(=O)CC(NC(=O)C(N)CO)(C(=O)O)C(=O)O)=C1O
InChI	InChI=1S/C13H18N4O9/c14-2-5-8(20)7(10(22)16-5)6(19)1-13(11(23)24,12(25)26)17-9(21)4(15)3-18/h4-5,18,20H,1-3,14-15H2,(H,16,22)(H,17,21)(H,23,24)(H,25,26)
InChIKey	IPQOAJQXCZEYLK-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces (ncbitaxon:1883)	-	DOI (10.1016/S0040-4039(01)85021-8)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Malonomicin (CHEBI:218407) is a dipeptide (CHEBI:46761)

IUPAC Name
2-[(2-amino-3-hydroxypropanoyl)amino]-2-[2-[2-(aminomethyl)-3-hydroxy-5-oxo-1,2-dihydropyrrol-4-yl]-2-oxoethyl]propanedioic acid

Manual Xrefs	Databases
10254483	ChemSpider