Stravidin S5 (CHEBI:216023)

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CHEBI:216023 - Stravidin S5

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ChEBI ID	CHEBI:216023
ChEBI Name	Stravidin S5
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C19H31N3O4
Net Charge	0
Average Mass	365.474
Monoisotopic Mass	365.23146
SMILES	CCC(C)[C@H](NC)C(=O)N[C@@H](CCC1C=CC(NC(C)=O)C=C1)C(=O)O
InChI	InChI=1S/C19H31N3O4/c1-5-12(2)17(20-4)18(24)22-16(19(25)26)11-8-14-6-9-15(10-7-14)21-13(3)23/h6-7,9-10,12,14-17,20H,5,8,11H2,1-4H3,(H,21,23)(H,22,24)(H,25,26)/t12?,14?,15?,16-,17-/m0/s1
InChIKey	MIBQEEUTDAZFDR-QBVSNWLOSA-N

Species of Metabolite	Component	Source	Comments
Streptomycesspecies NRRL S-98 (ncbitaxon:1463922)	-	PubMed (31887014)

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	Stravidin S5 (CHEBI:216023) is a dipeptide (CHEBI:46761)

IUPAC Name
(2S)-4-(4-acetamidocyclohexa-2,5-dien-1-yl)-2-[[(2S)-3-methyl-2-(methylamino)pentanoyl]amino]butanoic acid