CHEBI:80751 - (S)-goitrin

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ChEBI Name (S)-goitrin
ChEBI ID CHEBI:80751
ChEBI ASCII Name (S)-goitrin
Definition A 5-ethenyl-1,3-oxazolidine-2-thione that has S-configuration. It is a constituent of a traditional Chinese herbal medicine, Radix isatidis.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C5H7NOS
Net Charge 0
Average Mass 129.180
Monoisotopic Mass 129.02484
InChI InChI=1S/C5H7NOS/c1-2-4-3-6-5(8)7-4/h2,4H,1,3H2,(H,6,8)/t4-/m0/s1
InChIKey UZQVYLOFLQICCT-BYPYZUCNSA-N
SMILES [H][C@@]1(CNC(=S)O1)C=C
Metabolite of Species Details
Isatis tinctoria (NCBI:txid161756) Found in Root (BTO:0001188). See: PubMed
Roles Classification
Biological Role(s): antiviral agent
A substance that destroys or inhibits replication of viruses.
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
antithyroid drug
A drug used to treat hyperthyroidism by reducing the excessive production of thyroid hormones.
Application(s): antithyroid drug
A drug used to treat hyperthyroidism by reducing the excessive production of thyroid hormones.
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ChEBI Ontology
Outgoing (S)-goitrin (CHEBI:80751) has role antithyroid drug (CHEBI:50671)
(S)-goitrin (CHEBI:80751) has role antiviral agent (CHEBI:22587)
(S)-goitrin (CHEBI:80751) has role plant metabolite (CHEBI:76924)
(S)-goitrin (CHEBI:80751) is a 5-ethenyl-1,3-oxazolidine-2-thione (CHEBI:183227)
(S)-goitrin (CHEBI:80751) is enantiomer of (R)-goitrin (CHEBI:183228)
Incoming (RS)-goitrin (CHEBI:183226) has part (S)-goitrin (CHEBI:80751)
(R)-goitrin (CHEBI:183228) is enantiomer of (S)-goitrin (CHEBI:80751)
IUPAC Name
(5S)-5-ethenyl-1,3-oxazolidine-2-thione
Synonyms Sources
(−)-5-vinyl-2-oxazolidinethione ChemIDplus
(5S)-5-ethenyl-2-oxazolidinethione ChEBI
(S)-(−)-goitrin ChEBI
(S)-5-ethenyl-2-oxazolidinethione ChemIDplus
(S)-5-vinyloxazolidine-2-thione ChEBI
goitrin UniProt
goitrin ChemIDplus
L-5-vinyl-2-oxazolidinethione ChEBI
L-5-vinyl-2-thiooxazolidone ChEBI
L-goitrin ChEBI
Manual Xrefs Databases
5885349 ChemSpider
C16817 KEGG COMPOUND
CN101445490 Patent
CN101863850 Patent
View more database links
Registry Number Type Source
500-12-9 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
20551074 PubMed citation Europe PMC
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Last Modified
02 November 2021