2-[(E)-{2-[2-amino-2-(4-hydroxyphenyl)acetamido]-2-carboxyethylidene}amino]-3-methyl-3-sulfanylbutanoic acid (CHEBI:143345)

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CHEBI:143345 - 2-[(E)-{2-[2-amino-2-(4-hydroxyphenyl)acetamido]-2-carboxyethylidene}amino]-3-methyl-3-sulfanylbutanoic acid

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ChEBI ID	CHEBI:143345
ChEBI Name	2-[(E)-{2-[2-amino-2-(4-hydroxyphenyl)acetamido]-2-carboxyethylidene}amino]-3-methyl-3-sulfanylbutanoic acid
Stars
Submitter	mwilliams
Downloads	Molfile

Formula	C16H21N3O6S
Net Charge	0
Average Mass	383.426
Monoisotopic Mass	383.11511
SMILES	CC(C)(S)C(/N=C/[C@H](NC(=O)C(N)c1ccc(O)cc1)C(=O)O)C(=O)O
InChI	InChI=1S/C16H21N3O6S/c1-16(2,26)12(15(24)25)18-7-10(14(22)23)19-13(21)11(17)8-3-5-9(20)6-4-8/h3-7,10-12,20,26H,17H2,1-2H3,(H,19,21)(H,22,23)(H,24,25)/b18-7+/t10-,11?,12?/m0/s1
InChIKey	GBJZGFKPZVOVSS-OFGSZRCTSA-N

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	2-[(E)-{2-[2-amino-2-(4-hydroxyphenyl)acetamido]-2-carboxyethylidene}amino]-3-methyl-3-sulfanylbutanoic acid (CHEBI:143345) is a peptide (CHEBI:16670)