CHEBI:173453 - 4-(Methylthio)butanal

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 4-(Methylthio)butanal
ChEBI ID CHEBI:173453
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C5H10OS
Net Charge 0
Average Mass 118.190
Monoisotopic Mass 118.04524
InChI InChI=1S/C5H10OS/c1-7-5-3-2-4-6/h4H,2-3,5H2,1H3
InChIKey RZBUXNXJKZHGLL-UHFFFAOYSA-N
SMILES S(CCCC=O)C
ChEBI Ontology
Outgoing 4-(Methylthio)butanal (CHEBI:173453) is a aldehyde (CHEBI:17478)
IUPAC Name
4-methylsulanylbutanal
Manual Xrefs Databases
55848 ChemSpider
HMDB0037474 HMDB
View more database links
Registry Number Type Source
42919-64-2 CAS Registry Number ChemIDplus