Rhabdopeptide 2 (CHEBI:219350)

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CHEBI:219350 - Rhabdopeptide 2

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ChEBI ID	CHEBI:219350
ChEBI Name	Rhabdopeptide 2
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C32H55N5O4
Net Charge	0
Average Mass	573.823
Monoisotopic Mass	573.42541
SMILES	CN[C@@H](C(=O)N(C)[C@H](CC(C)C)C(=O)N[C@@H](C(=O)N(C)[C@@H](C(=O)NCCc1ccccc1)C(C)C)C(C)C)C(C)C
InChI	InChI=1S/C32H55N5O4/c1-20(2)19-25(36(10)31(40)26(33-9)21(3)4)29(38)35-27(22(5)6)32(41)37(11)28(23(7)8)30(39)34-18-17-24-15-13-12-14-16-24/h12-16,20-23,25-28,33H,17-19H2,1-11H3,(H,34,39)(H,35,38)/t25-,26-,27-,28-/m1/s1
InChIKey	KMULXIYSBJRYMS-BIYDSLDMSA-N

Species of Metabolite	Component	Source	Comments
Xenorhabdus nematophila (ncbitaxon:628)	-	PubMed (24038745)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Rhabdopeptide 2 (CHEBI:219350) is a peptide (CHEBI:16670)

IUPAC Name
(2R)-4-methyl-2-[methyl-[(2R)-3-methyl-2-(methylamino)butanoyl]amino]-N-[(2R)-3-methyl-1-[methyl-[(2R)-3-methyl-1-oxo-1-(2-phenylethylamino)butan-2-yl]amino]-1-oxobutan-2-yl]pentanamide

Manual Xrefs	Databases
78442826	ChemSpider