LIPID MAPS

Common Name

LacCer(d22:2(4E,8E)/15:0(2OH[R]))

Systematic Name

N-(2R-hydroxypentadecanoyl)-1-β-lactosyl-4E,8E-docosasphingadienine

LM ID

LMSP05019K10

Status

Active (generated by computational methods)

Exact Mass

Calculate m/z

917.643959

Formula

C₄₉H₉₁NO₁₄

Download as...

MDLMOL SDF CSV TSV PNG

MDLMOL files can be opened in various drawing programs. In ChemDraw, open as filetype "MDL Molfile".

Classification

String Representations

InChiKey (Click to copy)

PANBIBZZGMXIOU-HOFIYJQOSA-N

InChi (Click to copy)

InChI=1S/C49H91NO14/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-23-25-27-29-31-37(53)36(50-47(60)38(54)32-30-28-26-24-21-14-12-10-8-6-4-2)35-61-48-45(59)43(57)46(40(34-52)63-48)64-49-44(58)42(56)41(55)39(33-51)62-49/h22-23,29,31,36-46,48-49,51-59H,3-21,24-28,30,32-35H2,1-2H3,(H,50,60)/b23-22+,31-29+/t36-,37+,38+,39+,40+,41-,42?,43?,44?,45?,46+,48+,49-/m0/s1

SMILES (Click to copy)

[C@](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)C(O)C2O)C(O)C1O)([H])(NC([C@H](O)CCCCCCCCCCCCC)=O)[C@]([H])(O)/C=C/CC/C=C/CCCCCCCCCCCCC