Analyte Name

1-(((1-Oxohexadecyl)oxy)methyl)-2-(((9Z)-1-oxo-9-octadecen-1-yl)oxy)ethyl (4Z,7Z,10Z,13Z,16Z,19Z)-4,7,10,13,16,19-docosahexaenoate-D5

Molecular Formula

C59 D5 H95 O6

Molecular Weight

910.452

Accurate Mass

909.783

SMILES

[2H]C([2H])(OC(=O)CCCCCCCCCCCCCCC)C([2H])(OC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC)C([2H])([2H])OC(=O)CCCCCCC\C=C/CCCCCCCC

InChI

InChI=1S/C59H100O6/c1-4-7-10-13-16-19-22-25-27-28-29-30-32-35-38-41-44-47-50-53-59(62)65-56(54-63-57(60)51-48-45-42-39-36-33-24-21-18-15-12-9-6-3)55-64-58(61)52-49-46-43-40-37-34-31-26-23-20-17-14-11-8-5-2/h7,10,16,19,25-27,29-31,35,38,44,47,56H,4-6,8-9,11-15,17-18,20-24,28,32-34,36-37,39-43,45-46,48-55H2,1-3H3/b10-7-,19-16-,27-25-,30-29-,31-26-,38-35-,47-44-/i54D2,55D2,56D

IUPAC

[1,1,2,3,3-pentadeuterio-1-hexadecanoyloxy-3-[(Z)-octadec-9-enoyl]oxypropan-2-yl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate

Unlabelled CAS Number

1428732-77-7

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat