Structure database (LMSD)

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LM IDLMSP01040003
Common NameC17 Sphinganine
Systematic Nameheptadecasphinganine
Synonyms-
Exact Mass
287.2824 (neutral)    Calculate m/z:
FormulaC17H37NO2
CategorySphingolipids [SP]
Main ClassSphingoid bases [SP01]
Sub ClassSphingoid base homologs and variants [SP0104]
AbbrevSPB 17:0;O2
PubChem CID3247037
CHEBI ID137124
CAYMAN ID22510
AVANTI IDLM2001
InChIKeyKFQUQCFJDMSIJF-DLBZAZTESA-N  Show lipids differing only in stereochemistry/bond geometry
InChI
InChI=1S/C17H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(20)16(18)15-19/h16-17,19-20H,2-15,18H2,1H3/t16-,17+/m0/s1
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SMILES
OC[C@]([H])(N)[C@]([H])(O)CCCCCCCCCCCCCC
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MS StandardView lipid standard
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms20Rings0Aromatic Rings0Rotatable Bonds15
 van der Waals
Molecular Volume
331.24Topological Polar
Surface Area
66.48Hydrogen
Bond Donors
3Hydrogen
Bond Acceptors
2
 logP4.62Molar
Refractivity
88.28