EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:184539 - 2-Amino-3-{[(1E)-3-(prop-2-ene-1-sulfinyl)prop-1-en-1-yl]disulfanyl}propanoic acid

ChEBI IDCHEBI:184539
ChEBI Name2-Amino-3-{[(1E)-3-(prop-2-ene-1-sulfinyl)prop-1-en-1-yl]disulfanyl}propanoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H15NO3S3
Net Charge0
Average Mass281.424
Monoisotopic Mass281.02141
SMILESC=CCS(=O)C/C=C/SSCC(N)C(=O)O
InChIInChI=1S/C9H15NO3S3/c1-2-5-16(13)6-3-4-14-15-7-8(10)9(11)12/h2-4,8H,1,5-7,10H2,(H,11,12)/b4-3+
InChIKeyURBPKPSYQPHFAT-ONEGZZNKSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
ChEBI Ontology
Outgoing Relation(s)
2-Amino-3-{[(1E)-3-(prop-2-ene-1-sulfinyl)prop-1-en-1-yl]disulfanyl}propanoic acid (CHEBI:184539) is a cysteine derivative (CHEBI:23509)
IUPAC Name 
2-amino-3-[[(E)-3-prop-2-enylsulinylprop-1-enyl]disulanyl]propanoic acid
Manual XrefsDatabases
HMDB0041052HMDB
35015087ChemSpider