5,5-Dimethyl-1,3-thiazolane-4-carboxylic acid (CHEBI:194751)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	5,5-Dimethyl-1,3-thiazolane-4-carboxylic acid

ChEBI ID	CHEBI:194751

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C6H11NO2S

Net Charge

Average Mass

161.220

Monoisotopic Mass

161.05105

InChI

InChI=1S/C6H11NO2S/c1-6(2)4(5(8)9)7-3-10-6/h4,7H,3H2,1-2H3,(H,8,9)

InChIKey

PMQQFSDIECYOQV-UHFFFAOYSA-N

SMILES

S1C(C(NC1)C(O)=O)(C)C

ChEBI Ontology
Outgoing	5,5-Dimethyl-1,3-thiazolane-4-carboxylic acid (CHEBI:194751) has functional parent α-amino acid (CHEBI:33704) 5,5-Dimethyl-1,3-thiazolane-4-carboxylic acid (CHEBI:194751) is a organonitrogen compound (CHEBI:35352) 5,5-Dimethyl-1,3-thiazolane-4-carboxylic acid (CHEBI:194751) is a organooxygen compound (CHEBI:36963)

IUPAC Name

5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid