EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:61448 - isopropyl β-D-thiogalactopyranoside

ChEBI IDCHEBI:61448
ChEBI Nameisopropyl β-D-thiogalactopyranoside
Stars
ASCII Nameisopropyl beta-D-thiogalactopyranoside
DefinitionAn S-glycosyl compound consisting of β-D-1-thiogalactose having an isopropyl group attached to the anomeric sulfur.
Secondary ChEBI IDCHEBI:43601
Last Modified16 July 2015
Submitterlukasendler
DownloadsMolfile
FormulaC9H18O5S
Net Charge0
Average Mass238.305
Monoisotopic Mass238.08749
SMILESCC(C)S[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C9H18O5S/c1-4(2)15-9-8(13)7(12)6(11)5(3-10)14-9/h4-13H,3H2,1-2H3/t5-,6+,7+,8-,9+/m1/s1
InChIKeyBPHPUYQFMNQIOC-NXRLNHOXSA-N
ChEBI Ontology
Outgoing Relation(s)
isopropyl β-D-thiogalactopyranoside (CHEBI:61448) is a S-glycosyl compound (CHEBI:35275)
Synonyms  Source
IPTGSUBMITTER
isopropyl β-D-1-thiogalactopyranosideChEBI
isopropyl β-D-thiogalactosideChemIDplus
isopropyl thiogalactosideChemIDplus
isopropyl-β-D-thiogalactopyranosideChemIDplus
isopropyl-β-D-thiogalactosideChemIDplus
Manual XrefsDatabases
IPTPDBeChem
US6995145Patent
Registry NumbersSources
Reaxys:4631Reaxys
CAS:367-93-1ChemIDplus
Citations