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CHEBI:72800 - sphinga-4E,8E-dienine

ChEBI IDCHEBI:72800
ChEBI Namesphinga-4E,8E-dienine
Stars
ASCII Namesphinga-4E,8E-dienine
DefinitionA sphingoid that is sphingosine having an additional trans-double bond at position 8.
Last Modified1 July 2015
SubmitterSteve
DownloadsMolfile
FormulaC18H35NO2
Net Charge0
Average Mass297.483
Monoisotopic Mass297.26678
SMILESCCCCCCCCC/C=C/CC/C=C/[C@@H](O)[C@@H](N)CO
InChIInChI=1S/C18H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h10-11,14-15,17-18,20-21H,2-9,12-13,16,19H2,1H3/b11-10+,15-14+/t17-,18+/m0/s1
InChIKeyRTQVJTLVVBJRJG-SEXYCKHXSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS143)
Roles Classification
Biological Role:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
sphinga-4E,8E-dienine (CHEBI:72800) has functional parent sphingosine (CHEBI:16393)
sphinga-4E,8E-dienine (CHEBI:72800) has role mouse metabolite (CHEBI:75771)
sphinga-4E,8E-dienine (CHEBI:72800) is a sphingoid (CHEBI:35785)
sphinga-4E,8E-dienine (CHEBI:72800) is conjugate base of sphinga-4E,8E-dienine(1+) (CHEBI:72758)
Incoming Relation(s)
N-acyl-(4E,8E)-sphinga-4,8-dienine (CHEBI:85953) has functional parent sphinga-4E,8E-dienine (CHEBI:72800)
sphinga-4E,8E-dienine(1+) (CHEBI:72758) is conjugate acid of sphinga-4E,8E-dienine (CHEBI:72800)
IUPAC Name 
(2S,3R,4E,8E)-2-aminooctadeca-4,8-diene-1,3-diol
Synonyms  Source
sphinga-4E,8E-dieneLIPID MAPS
sphingadieneLIPID MAPS
(4E,8E,d18:2)sphingosineLIPID MAPS
trans,trans-sphinga-4,8-dieneChEBI
8,9-didehydrosphingosineChEBI
Manual XrefsDatabases
LMSP01080010LIPID MAPS
Registry NumbersSources
Reaxys:2331800Reaxys