Conagenin (CHEBI:221460)

EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:221460 - Conagenin

Take structure to advanced search

ChEBI ID	CHEBI:221460
ChEBI Name	Conagenin
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C10H19NO6
Net Charge	0
Average Mass	249.263
Monoisotopic Mass	249.12124
SMILES	C[C@@H]([C@@H](C)O)[C@@H](O)C(=O)N[C@@](C)(CO)C(=O)O
InChI	InChI=1S/C10H19NO6/c1-5(6(2)13)7(14)8(15)11-10(3,4-12)9(16)17/h5-7,12-14H,4H2,1-3H3,(H,11,15)(H,16,17)/t5-,6+,7+,10-/m0/s1
InChIKey	GLESHRYLRAOJPS-DHCFDGJBSA-N

Species of Metabolite	Component	Source	Comments
Streptomyces (ncbitaxon:1883)	-	PubMed (1905708)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Conagenin (CHEBI:221460) is a N-acyl-L-amino acid (CHEBI:21644)

IUPAC Name
(2S)-2-[[(2R,3S,4R)-2,4-dihydroxy-3-methylpentanoyl]amino]-3-hydroxy-2-methylpropanoic acid

Manual Xrefs	Databases
8057082	ChemSpider