EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:183104 - (2R)-2-hydroxy-3-butenyl isothiocyanate

ChEBI IDCHEBI:183104
ChEBI Name(2R)-2-hydroxy-3-butenyl isothiocyanate
Stars
ASCII Name(2R)-2-hydroxy-3-butenyl isothiocyanate
Last Modified6 June 2022
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC5H7NOS
Net Charge0
Average Mass129.184
Monoisotopic Mass129.02483
SMILESC=C[C@H](O)CN=C=S
InChIInChI=1S/C5H7NOS/c1-2-5(7)3-6-4-8/h2,5,7H,1,3H2/t5-/m0/s1
InChIKeyPTOIGEILFJSALG-YFKPBYRVSA-N
ChEBI Ontology
Outgoing Relation(s)
(2R)-2-hydroxy-3-butenyl isothiocyanate (CHEBI:183104) is a isothiocyanate (CHEBI:52221)
UniProt Name  Source
(2R)-2-hydroxy-3-butenyl isothiocyanateUniProt
Manual XrefsDatabases
11752388MetaCyc