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CHEBI:45719 - (2R,3S,4Z)-2-aminooctadec-4-ene-1,3-diol

Default Structure
ChEBI IDCHEBI:45719
ChEBI Name(2R,3S,4Z)-2-aminooctadec-4-ene-1,3-diol
Stars
ASCII Name(2R,3S,4Z)-2-aminooctadec-4-ene-1,3-diol
Last Modified16 May 2008
DownloadsMolfile
FormulaC18H37NO2
Net Charge0
Average Mass299.499
Monoisotopic Mass299.28243
SMILESCCCCCCCCCCCCC/C=C\[C@H](O)[C@H](N)CO
InChIInChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14-/t17-,18+/m1/s1
InChIKeyWWUZIQQURGPMPG-BXDGKWANSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
(2R,3S,4Z)-2-aminooctadec-4-ene-1,3-diol (CHEBI:45719) is a (2R,3S)-2-aminooctadec-4-ene-1,3-diol (CHEBI:46965)
(2R,3S,4Z)-2-aminooctadec-4-ene-1,3-diol (CHEBI:45719) is enantiomer of cis-sphingosine (CHEBI:46962)
Incoming Relation(s)
cis-sphingosine (CHEBI:46962) is enantiomer of (2R,3S,4Z)-2-aminooctadec-4-ene-1,3-diol (CHEBI:45719)
IUPAC Name 
(2R,3S,4Z)-2-aminooctadec-4-ene-1,3-diol
Synonym  Source
SPHINGOSINEPDBeChem
Manual XrefsDatabases
SPHPDBeChem