ovothiol C (CHEBI:83415)

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ChEBI Name	ovothiol C

ChEBI ID	CHEBI:83415

Definition	A L-histidine derivative that is N,N-dimethyl-L-histidine substituted at positions N3 and C5 on the imidazole ring by methyl and mercapto groups respectively.

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

Supplier Information

Download	Molfile XML SDF

Formula

C9H15N3O2S

Net Charge

Average Mass

229.29900

Monoisotopic Mass

229.08850

InChI

InChI=1S/C9H15N3O2S/c1-11(2)7(9(13)14)4-6-8(15)10-5-12(6)3/h5,7,15H,4H2,1-3H3,(H,13,14)/t7-/m0/s1

InChIKey

ONAWDGXCZMVYMN-ZETCQYMHSA-N

SMILES

CN(C)[C@@H](Cc1c(S)ncn1C)C(O)=O

Metabolite of Species	Details
Strongylocentrotus purpuratus (NCBI:txid7668)	See: PubMed

Roles Classification
Chemical Role(s):	radical scavenger A role played by a substance that can react readily with, and thereby eliminate, radicals. antioxidant A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.

Biological Role(s):	marine metabolite Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.

ChEBI Ontology
Outgoing	ovothiol C (CHEBI:83415) has role antioxidant (CHEBI:22586) ovothiol C (CHEBI:83415) has role marine metabolite (CHEBI:76507) ovothiol C (CHEBI:83415) has role radical scavenger (CHEBI:48578) ovothiol C (CHEBI:83415) is a L-histidine derivative (CHEBI:84076) ovothiol C (CHEBI:83415) is a aryl thiol (CHEBI:82711) ovothiol C (CHEBI:83415) is tautomer of ovothiol C zwitterion (CHEBI:82725)

Incoming	ovothiol C zwitterion (CHEBI:82725) is tautomer of ovothiol C (CHEBI:83415)

IUPAC Name

N,N,3-trimethyl-5-sulfanyl-L-histidine

Synonyms	Sources
1-Methyl-alpha(N), alpha(N)-dimethyl-4-thiohistidine	ChemIDplus
L-ovothiol C	ChEBI

Last Modified

07 January 2015