N-Acetyl-S-(4-hydroxy-2-buten-1-yl)-cysteine (CHEBI:165886)

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CHEBI:165886 - N-Acetyl-S-(4-hydroxy-2-buten-1-yl)-cysteine

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ChEBI ID	CHEBI:165886
ChEBI Name	N-Acetyl-S-(4-hydroxy-2-buten-1-yl)-cysteine
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C9H15NO4S
Net Charge	0
Average Mass	233.289
Monoisotopic Mass	233.07218
SMILES	CC(=O)N[C@H](CSC/C=C/CO)C(=O)O
InChI	InChI=1S/C9H15NO4S/c1-7(12)10-8(9(13)14)6-15-5-3-2-4-11/h2-3,8,11H,4-6H2,1H3,(H,10,12)(H,13,14)/b3-2+/t8-/m1/s1
InChIKey	CGYFKBWVTSXRDZ-UFUPEUMYSA-N

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	N-Acetyl-S-(4-hydroxy-2-buten-1-yl)-cysteine (CHEBI:165886) is a N-acyl-amino acid (CHEBI:51569)

IUPAC Name
(2S)-2-acetamido-3-[(E)-4-hydroxybut-2-enyl]sulanylpropanoic acid