CHEBI:193636 - 3-Mercapto-2-methylpentanol

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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 3-Mercapto-2-methylpentanol
ChEBI ID CHEBI:193636
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C6H14OS
Net Charge 0
Average Mass 134.240
Monoisotopic Mass 134.07654
InChI InChI=1S/C6H14OS/c1-3-6(8)5(2)4-7/h5-8H,3-4H2,1-2H3
InChIKey HABNNYNSJFKZFE-UHFFFAOYSA-N
SMILES SC(C(CO)C)CC
Metabolite of Species Details
mock community culture Found in Whole Organism (NCIT:C13413). See: MetaboLights Study
ChEBI Ontology
Outgoing 3-Mercapto-2-methylpentanol (CHEBI:193636) is a alkanethiol (CHEBI:47908)
IUPAC Name
2-methyl-3-sulanylpentan-1-ol
Manual Xrefs Databases
4936226 ChemSpider
HMDB0034878 HMDB
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Registry Number Type Source
227456-27-1 CAS Registry Number ChemIDplus