Structure Database (LMSD)
Common Name
C16 Sphingosine
Systematic Name
Hexadecasphing-4E-enine
Synonyms
- Hexadecasphingosine
LM ID
LMSP01040008
Formula
Exact Mass
Calculate m/z
271.251129
Sum Composition
Status
Active
3D model of C16 Sphingosine
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
String Representations
InChiKey (Click to copy)
BTUSGZZCQZACPT-YYZTVXDQSA-N
InChi (Click to copy)
InChI=1S/C16H33NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16(19)15(17)14-18/h12-13,15-16,18-19H,2-11,14,17H2,1H3/b13-12+/t15-,16+/m0/s1
SMILES (Click to copy)
OC[C@]([H])(N)[C@]([H])(O)/C=C/CCCCCCCCCCC
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
19
Rings
0
Aromatic Rings
0
Rotatable Bonds
13
Van der Waals Molecular Volume
311.30
Topological Polar Surface Area
66.48
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
2
logP
4.00
Molar Refractivity
83.57
Admin
Created at
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Updated at
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