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CHEBI:16566 - sphinganine

ChEBI IDCHEBI:16566
ChEBI Namesphinganine
Stars
DefinitionA 2-aminooctadecane-1,3-diol having (2S,3R)-configuration.
Secondary ChEBI IDsCHEBI:9221, CHEBI:15099, CHEBI:26736, CHEBI:26737, CHEBI:549953
Last Modified26 January 2018
DownloadsMolfile
FormulaC18H39NO2
Net Charge0
Average Mass301.515
Monoisotopic Mass301.29808
SMILESCCCCCCCCCCCCCCC[C@@H](O)[C@@H](N)CO
InChIInChI=1S/C18H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h17-18,20-21H,2-16,19H2,1H3/t17-,18+/m0/s1
InChIKeyOTKJDMGTUTTYMP-ZWKOTPCHSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090)
- MetaboLights (MTBLS143)
- PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
EC 2.7.11.13 (protein kinase C) inhibitor  An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of protein kinase C (EC 2.7.11.13).
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
sphinganine (CHEBI:16566) has role EC 2.7.11.13 (protein kinase C) inhibitor (CHEBI:37700)
sphinganine (CHEBI:16566) has role human metabolite (CHEBI:77746)
sphinganine (CHEBI:16566) has role mouse metabolite (CHEBI:75771)
sphinganine (CHEBI:16566) is a 2-aminooctadecane-1,3-diol (CHEBI:46968)
sphinganine (CHEBI:16566) is conjugate base of sphinganine(1+) (CHEBI:57817)
Incoming Relation(s)
N-(2-hydroxytetracosanoyl)sphinganine (CHEBI:52371) has functional parent sphinganine (CHEBI:16566)
N-acylsphinganine (CHEBI:31488) has functional parent sphinganine (CHEBI:16566)
N-acylsphinganine-1-phosphocholine (CHEBI:67090) has functional parent sphinganine (CHEBI:16566)
N-hexacosanoylsphinganine (CHEBI:52962) has functional parent sphinganine (CHEBI:16566)
D-glucosylsphinganine (CHEBI:27423) has functional parent sphinganine (CHEBI:16566)
1-deoxymethylsphinganine (CHEBI:67187) has functional parent sphinganine (CHEBI:16566)
1-deoxysphinganine (CHEBI:67106) has functional parent sphinganine (CHEBI:16566)
3-dehydrosphinganine (CHEBI:17862) has functional parent sphinganine (CHEBI:16566)
hexosyl-(1↔1')-N-acylsphinganine (CHEBI:82918) has functional parent sphinganine (CHEBI:16566)
inositol phosphomannosylinositol-1-phosphodihydroceramide (CHEBI:139531) has functional parent sphinganine (CHEBI:16566)
phytosphingosine (CHEBI:46961) has functional parent sphinganine (CHEBI:16566)
sphinganine 1-phosphate (CHEBI:16893) has functional parent sphinganine (CHEBI:16566)
sphinganine-1-phosphocholine (CHEBI:132478) has functional parent sphinganine (CHEBI:16566)
sphinganine-based sphingolipid (CHEBI:82829) has functional parent sphinganine (CHEBI:16566)
β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1')-N-acylsphinganine (CHEBI:82926) has functional parent sphinganine (CHEBI:16566)
sphinganine(1+) (CHEBI:57817) is conjugate acid of sphinganine (CHEBI:16566)
IUPAC Name 
sphinganine
Synonyms  Source
SphinganineKEGG COMPOUND
DihydrosphingosineKEGG COMPOUND
2-Amino-1,3-dihydroxyoctadecaneKEGG COMPOUND
(2S,3R)-2-aminooctadecane-1,3-diolJCBN
SafingolChemIDplus
C18-dihydrosphingosineChemIDplus
Manual XrefsDatabases
C00836KEGG COMPOUND
LMSP01020001LIPID MAPS
CPD-13612MetaCyc
HMDB0000269HMDB
C00007540KNApSAcK
Registry NumbersSources
Reaxys:1724230Reaxys
CAS:764-22-7ChemIDplus
CAS:764-22-7KEGG COMPOUND
Citations