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Chemical structure of Methyl hexadeca-4,7,10,13-tetraenoate

GC42321

Methyl hexadeca-4,7,10,13-tetraenoate

Also listed as 4(Z),7(Z),10(Z),13(Z)-Hexadecatetraenoic Acid methyl ester

4(Z),7(Z),10(Z),13(Z)-Hexadecatetraenoic acid methyl ester is the methyl ester version of an unusual polyunsaturated fatty acid (PUFA) generated during the synthesis of docosahexaenoic acid-d5

ChemicalCAS873108-81-7MW262.4FormulaC17H26O2
CAS number
873108-81-7
Molecular weight
262.4
Formula
C17H26O2
Solubility
DMF： 100 mg/mL,DMSO： 100 mg/mL,Ethanol： 500 mg/mL,PBS (pH 7·2)： 0·15 mg/mL
InChIKey
GRTBKGOZZPTTEE-UHFFFAOYSA-N
Catalogue number
GC42321
Brand
GLPBIO
Computed properties PubChem CID 71413142 · XLogP 4.6 · TPSA 26.3 Ų · H-bond donors 0
XLogP
4.6
TPSA
26.3 Ų
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
11
Heavy atoms
19

SMILES CCC=CCC=CCC=CCC=CCCC(=O)OC

Computed descriptors from PubChem (CID 71413142), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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