S-allylcysteine (CHEBI:74077)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	S-allylcysteine

ChEBI ID	CHEBI:74077

ChEBI ASCII Name	S-allylcysteine

Definition	An S-hydrocarbyl-L-cysteine that is L-cysteine in which the hydrogen attached to the sulphur is replaced by a prop-2-enyl group. It commonly occurs in garlic and has been found to exhibit antineoplastic activity.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

more structures >>

Wikipedia	License

Read full article at Wikipedia

Formula

C6H11NO2S

Net Charge

Average Mass

161.22200

Monoisotopic Mass

161.05105

InChI

InChI=1S/C6H11NO2S/c1-2-3-10-4-5(7)6(8)9/h2,5H,1,3-4,7H2,(H,8,9)/t5-/m0/s1

InChIKey

ZFAHNWWNDFHPOH-YFKPBYRVSA-N

SMILES

N[C@@H](CSCC=C)C(O)=O

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	S-allylcysteine (CHEBI:74077) has role antineoplastic agent (CHEBI:35610) S-allylcysteine (CHEBI:74077) has role metabolite (CHEBI:25212) S-allylcysteine (CHEBI:74077) is a S-hydrocarbyl-L-cysteine (CHEBI:47913) S-allylcysteine (CHEBI:74077) is tautomer of S-allylcysteine zwitterion (CHEBI:133648)

Incoming	S-allylcysteine zwitterion (CHEBI:133648) is tautomer of S-allylcysteine (CHEBI:74077)

IUPAC Name

S-prop-2-en-1-yl-L-cysteine

Last Modified

13 October 2016