3-sulfino-L-alanine (CHEBI:16345)

CHEBI:16345 - 3-sulfino-L-alanine

ChEBI ID	CHEBI:16345
ChEBI Name	3-sulfino-L-alanine
Stars
ASCII Name	3-sulfino-L-alanine
Definition	The organosulfinic acid arising from oxidation of the sulfhydryl group of L-cysteine.
Secondary ChEBI IDs	CHEBI:1664, CHEBI:8973, CHEBI:11888, CHEBI:11889, CHEBI:21271, CHEBI:41618
Last Modified	27 January 2016
Downloads	Molfile

Formula	C3H7NO4S
Net Charge	0
Average Mass	153.159
Monoisotopic Mass	153.00958
SMILES	N[C@@H](CS(=O)O)C(=O)O
InChI	InChI=1S/C3H7NO4S/c4-2(3(5)6)1-9(7)8/h2H,1,4H2,(H,5,6)(H,7,8)/t2-/m0/s1
InChIKey	ADVPTQAUNPRNPO-REOHCLBHSA-N

Wikipedia

Species of Metabolite	Component	Source	Comments
Escherichia coli (ncbitaxon:562)	-	PubMed (21988831)
Mus musculus (ncbitaxon:10090)	-	PubMed (19425150)	Source: BioModels - MODEL1507180067

Roles Classification

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

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

metabotropic glutamate receptor agonist An agonist that selectively binds to and activates a metabotropic glutamate receptor.

mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).

human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).

Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.

ChEBI Ontology

Outgoing Relation(s)
	3-sulfino-L-alanine (CHEBI:16345) has role Escherichia coli metabolite (CHEBI:76971)
	3-sulfino-L-alanine (CHEBI:16345) has role human metabolite (CHEBI:77746)
	3-sulfino-L-alanine (CHEBI:16345) has role metabotropic glutamate receptor agonist (CHEBI:61966)
	3-sulfino-L-alanine (CHEBI:16345) has role mouse metabolite (CHEBI:75771)
	3-sulfino-L-alanine (CHEBI:16345) is a S-substituted L-cysteine (CHEBI:47910)
	3-sulfino-L-alanine (CHEBI:16345) is a organosulfinic acid (CHEBI:37783)
	3-sulfino-L-alanine (CHEBI:16345) is conjugate acid of 3-sulfino-L-alanine(1−) (CHEBI:61085)
	3-sulfino-L-alanine (CHEBI:16345) is tautomer of L-cysteine-S-dioxide (CHEBI:41721)
Incoming Relation(s)
	3-sulfino-L-alanine(1−) (CHEBI:61085) is conjugate base of 3-sulfino-L-alanine (CHEBI:16345)
	3-sulfino-L-alanine residue (CHEBI:61967) is substituent group from 3-sulfino-L-alanine (CHEBI:16345)
	L-cysteine-S-dioxide (CHEBI:41721) is tautomer of 3-sulfino-L-alanine (CHEBI:16345)

IUPAC Name
3-sulfino-L-alanine

Synonyms	Source
3-Sulfino-L-alanine	KEGG COMPOUND
L-Cysteinesulfinic acid	KEGG COMPOUND
3-Sulfinoalanine	KEGG COMPOUND
3-Sulphino-L-alanine	KEGG COMPOUND
(2R)-2-amino-3-sulfinopropanoic acid	IUPAC
3-SULFINOALANINE	PDBeChem

Citations