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Chemical structure of Tridocosahexaenoin

GC18690

Tridocosahexaenoin

Also known as 2,3-bis[[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy]propyl (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate

Tridocosahexaenoin is a triacylglycerol containing three docosahexaenoic acid groups· It is commonly found in fish oils

ChemicalCAS11094-59-0MW1023.5FormulaC69H98O6
CAS number
11094-59-0
Molecular weight
1023.5
Formula
C69H98O6
Solubility
Chloroform: miscible
InChIKey
SOFMPBOQLPVEQZ-LBUXZKOBSA-N
Catalogue number
GC18690
Brand
GLPBIO
Computed properties PubChem CID 9546569 · XLogP 19.2 · TPSA 78.9 Ų · H-bond donors 0
XLogP
19.2
TPSA
78.9 Ų
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
50
Heavy atoms
75

SMILES CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)OCC(OC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COC(=O)CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC

Computed descriptors from PubChem (CID 9546569), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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