Xenortide A (CHEBI:215427)

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CHEBI:215427 - Xenortide A

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ChEBI ID	CHEBI:215427
ChEBI Name	Xenortide A
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C25H35N3O2
Net Charge	0
Average Mass	409.574
Monoisotopic Mass	409.27293
SMILES	CN[C@@H](CC(C)C)C(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCc1ccccc1
InChI	InChI=1S/C25H35N3O2/c1-19(2)17-22(26-3)25(30)28(4)23(18-21-13-9-6-10-14-21)24(29)27-16-15-20-11-7-5-8-12-20/h5-14,19,22-23,26H,15-18H2,1-4H3,(H,27,29)/t22-,23-/m0/s1
InChIKey	UAFFXYUNGBKFSK-GOTSBHOMSA-N

Species of Metabolite	Component	Source	Comments
Xenorhabdus (ncbitaxon:626)	-	PubMed (18491867)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Xenortide A (CHEBI:215427) is a dipeptide (CHEBI:46761)

IUPAC Name
(2S)-N,4-dimethyl-2-(methylamino)-N-[(2S)-1-oxo-3-phenyl-1-(2-phenylethylamino)propan-2-yl]pentanamide

Manual Xrefs	Databases
24701892	ChemSpider