Eponemycin (CHEBI:220171)

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:220171 - Eponemycin

Take structure to advanced search

ChEBI ID	CHEBI:220171
ChEBI Name	Eponemycin
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C20H34N2O6
Net Charge	0
Average Mass	398.500
Monoisotopic Mass	398.24169
SMILES	C=C(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CCCCC(C)C)C(=O)[C@@]1(CO)CO1
InChI	InChI=1S/C20H34N2O6/c1-13(2)7-5-6-8-17(25)21-16(10-23)19(27)22-15(9-14(3)4)18(26)20(11-24)12-28-20/h13,15-16,23-24H,3,5-12H2,1-2,4H3,(H,21,25)(H,22,27)/t15-,16-,20+/m0/s1
InChIKey	ZPLVYYNMRMBNGE-TWOQFEAHSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces (ncbitaxon:1883)	-	PubMed (2106503)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	Eponemycin (CHEBI:220171) is a N-acyl-amino acid (CHEBI:51569)

IUPAC Name
N-[(2S)-3-hydroxy-1-[[(2S)-1-[(2R)-2-(hydroxymethyl)oxiran-2-yl]-4-methyl-1-oxopent-4-en-2-yl]amino]-1-oxopropan-2-yl]-6-methylheptanamide

Manual Xrefs	Databases
8267816	ChemSpider