Structure Database (LMSD)

Common Name
Sphinganine
Systematic Name
Sphinganine
Synonyms
  • Dihydrosphingosine
  • Octadecasphinganine
  • D-erythro-Sphinganine
  • D-erythro-2-Amino-1,3-octadecanediol
LM ID
LMSP01020001
Formula
C18H39NO2
Exact Mass
Calculate m/z
301.298079
Sum Composition
SPB 18:0;O2
Status
Active
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Classification

Category
Main Class
Sub Class
Sphingolipids [SP]
Sphingoid bases [SP01]
Sphinganines [SP0102]

Reactions

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ⓘ Reactions are shown if the E.C. number of the enzyme catalysing it is annotated in the UniProt database for a species belonging to the selected taxonomic class.
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Reactions graph legend

References

Taxonomy Information

Curated from
NCBI taxonomy class
Reference
Homo sapiens (#9606)
Mammalia (#40674)
Lipidomics reveals a remarkable diversity of lipids in human plasma,
J Lipid Res, 2010
Pubmed ID: 20671299

String Representations

InChiKey (Click to copy)
OTKJDMGTUTTYMP-ZWKOTPCHSA-N
InChi (Click to copy)
InChI=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
SMILES (Click to copy)
OC[C@]([H])(N)[C@]([H])(O)CCCCCCCCCCCCCCC

Other Databases

KEGG ID
C00836
HMDB ID
HMDB0000269
CHEBI ID
16566
PubChem CID
91486
SwissLipids ID
SLM:000000035
Cayman ID
10007945
GuidePharm ID
2453

Calculated Physicochemical Properties

Heavy Atoms 21
Rings 0
Aromatic Rings 0
Rotatable Bonds 16
Van der Waals Molecular Volume 348.54
Topological Polar Surface Area 66.48
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 2
logP 5.01
Molar Refractivity 92.89

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Updated at
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