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CHEBI:57934 - psychosine(1+)

ChEBI IDCHEBI:57934
ChEBI Namepsychosine(1+)
Stars
DefinitionThe ammonium ion resulting from the protonation of the amino group of psychosine.
Last Modified15 February 2019
DownloadsMolfile
FormulaC24H48NO7
Net Charge+1
Average Mass462.648
Monoisotopic Mass462.34253
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@@H]([NH3+])CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
InChIInChI=1S/C24H47NO7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(27)18(25)17-31-24-23(30)22(29)21(28)20(16-26)32-24/h14-15,18-24,26-30H,2-13,16-17,25H2,1H3/p+1/b15-14+/t18-,19+,20+,21-,22-,23+,24+/m0/s1
InChIKeyHHJTWTPUPVQKNA-PIIMIWFASA-O
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
psychosine(1+) (CHEBI:57934) has role human metabolite (CHEBI:77746)
psychosine(1+) (CHEBI:57934) is a ammonium ion derivative (CHEBI:35274)
psychosine(1+) (CHEBI:57934) is conjugate acid of psychosine (CHEBI:16874)
Incoming Relation(s)
psychosine (CHEBI:16874) is conjugate base of psychosine(1+) (CHEBI:57934)
IUPAC Name 
(2S,3R,4E)-1-(β-D-galactopyranosyloxy)-3-hydroxyoctadec-4-en-2-aminium
Synonym  Source
(2S,3R,4E)-3-hydroxy-1-{[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octadec-4-en-2-aminiumIUPAC
UniProt Name  Source
β-D-galactosyl-(1↔1)-sphing-4-enineUniProt