Stravidin S4 (CHEBI:216030)

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CHEBI:216030 - Stravidin S4

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ChEBI ID	CHEBI:216030
ChEBI Name	Stravidin S4
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C18H29N3O4
Net Charge	0
Average Mass	351.447
Monoisotopic Mass	351.21581
SMILES	CN[C@H](C(=O)N[C@@H](CCC1C=CC(NC(C)=O)C=C1)C(=O)O)C(C)C
InChI	InChI=1S/C18H29N3O4/c1-11(2)16(19-4)17(23)21-15(18(24)25)10-7-13-5-8-14(9-6-13)20-12(3)22/h5-6,8-9,11,13-16,19H,7,10H2,1-4H3,(H,20,22)(H,21,23)(H,24,25)/t13?,14?,15-,16-/m0/s1
InChIKey	SOFSTVNBQFOELD-CKUJCDMFSA-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 S4 (CHEBI:216030) is a dipeptide (CHEBI:46761)

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