Belactosin B (CHEBI:220299)

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CHEBI:220299 - Belactosin B

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ChEBI ID	CHEBI:220299
ChEBI Name	Belactosin B
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C18H31N3O7
Net Charge	0
Average Mass	401.460
Monoisotopic Mass	401.21620
SMILES	CC[C@H](C)[C@H](C(=O)OC)[C@@H](O)C(=O)N[C@H]1C[C@@H]1C[C@H](NC(=O)[C@H](C)N)C(=O)O
InChI	InChI=1S/C18H31N3O7/c1-5-8(2)13(18(27)28-4)14(22)16(24)20-11-6-10(11)7-12(17(25)26)21-15(23)9(3)19/h8-14,22H,5-7,19H2,1-4H3,(H,20,24)(H,21,23)(H,25,26)/t8-,9-,10+,11-,12-,13-,14+/m0/s1
InChIKey	GZUZMJQLRANFIY-DDASBUEYSA-N

Species of Metabolite	Component	Source	Comments
Streptomycesspecies (ncbitaxon:1931)	-	PubMed (10724015)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Belactosin B (CHEBI:220299) is a dipeptide (CHEBI:46761)

IUPAC Name
(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-[(1R,2S)-2-[[(2R,3S,4S)-2-hydroxy-3-methoxycarbonyl-4-methylhexanoyl]amino]cyclopropyl]propanoic acid

Manual Xrefs	Databases
78438201	ChemSpider