Structure database (LMSD)

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LM IDLMSP01080012
Common Name(4E,8E,9Me-d19:2)sphingosine
Systematic Name9-methyl-sphinga-4E,8E-dienine
Synonyms-
Exact Mass
311.2824 (neutral)    Calculate m/z:
FormulaC19H37NO2
CategorySphingolipids [SP]
Main ClassSphingoid bases [SP01]
Sub ClassSphingoid base analogs [SP0108]
PubChem CID10913955
InChIKeyQCUHPIBMMDIRKL-JWBJMZHVSA-N  Show lipids differing only in stereochemistry/bond geometry
InChIInChI=1S/C19H37NO2/c1-3-4-5-6-7-8-10-13-17(2)14-11-9-12-15-19(22)18(20)16-21/h12
,14-15,18-19,21-22H,3-11,13,16,20H2,1-2H3/b15-12+,17-14+/t18-,19+/m0/s1
SMILESC([C@H](N)[C@H](O)/C=C/CC/C=C(\C)/CCCCCCCCC)O
StatusActive
Calculated physicochemical properties (?):
 Heavy Atoms22Rings0Aromatic Rings0Rotatable Bonds14
 van der Waals
Molecular Volume
360.56Topological Polar
Surface Area
66.48Hydrogen
Bond Donors
3Hydrogen
Bond Acceptors
2
 logP4.95Molar
Refractivity
97.32