Namalide E (CHEBI:212780)

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CHEBI:212780 - Namalide E

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ChEBI ID	CHEBI:212780
ChEBI Name	Namalide E
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C28H43N5O6
Net Charge	0
Average Mass	545.681
Monoisotopic Mass	545.32133
SMILES	CCC(C)C(NC(=O)NC1CCCCNC(=O)C(CCc2ccccc2)NC(=O)C(C(C)C)NC1=O)C(=O)O
InChI	InChI=1S/C28H43N5O6/c1-5-18(4)23(27(37)38)33-28(39)31-20-13-9-10-16-29-24(34)21(15-14-19-11-7-6-8-12-19)30-26(36)22(17(2)3)32-25(20)35/h6-8,11-12,17-18,20-23H,5,9-10,13-16H2,1-4H3,(H,29,34)(H,30,36)(H,32,35)(H,37,38)(H2,31,33,39)
InChIKey	KSERJDNPRNPELX-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Nostocspecies CENA543 (ncbitaxon:1869241)	-	PubMed (28933529)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Namalide E (CHEBI:212780) is a cyclic peptide (CHEBI:23449)

IUPAC Name
3-methyl-2-[[2,5,8-trioxo-3-(2-phenylethyl)-6-propan-2-yl-1,4,7-triazacyclotridec-9-yl]carbamoylamino]pentanoic acid