CHEBI:173551 - Methyl 3-mercaptobutanoate

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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 Methyl 3-mercaptobutanoate
ChEBI ID CHEBI:173551
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
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Formula C5H10O2S
Net Charge 0
Average Mass 134.190
Monoisotopic Mass 134.04015
InChI InChI=1S/C5H10O2S/c1-4(8)3-5(6)7-2/h4,8H,3H2,1-2H3
InChIKey BHDKXXOGPCSBQI-UHFFFAOYSA-N
SMILES SC(CC(OC)=O)C
ChEBI Ontology
Outgoing Methyl 3-mercaptobutanoate (CHEBI:173551) is a fatty acid methyl ester (CHEBI:4986)
IUPAC Name
methyl 3-sulanylbutanoate
Manual Xrefs Databases
8074493 ChemSpider
HMDB0032409 HMDB
LMFA07010949 LIPID MAPS
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Registry Number Type Source
54051-19-3 CAS Registry Number ChemIDplus