FComEx: Glycerol trihexadecanoate (PC000909)

Record Information

Version

1.0

Creation date

2015-10-09 22:33:19 UTC

Update date

2017-01-19 02:36:40 UTC

FoodComEx ID

PC000909

FoodDB Record

FDB002911

Chemical Information

Name

Glycerol trihexadecanoate

Description

TG(16:0/16:0/16:0) belongs to the family of triradyglycerols, which are glycerolipids lipids containing a common glycerol backbone to which at least one fatty acyl group is esterified. Their general formula is [R1]OCC(CO[R2])O[R3]. TG(16:0/16:0/16:0) is made up of one hexadecanoyl(R1), one hexadecanoyl(R2), and one hexadecanoyl(R3).

CAS Number

555-44-2

Structure

MOL SDF PDB SMILES InChI

Synonyms

Synonym	Source
1,2,3-Propanetriol trihexadecanoate	biospider
1,2,3-Propanetriol trihexadecanoic acid	Generator
1,2,3-Propanetriyl hexadecanoate, 9CI	db_source
1,2,3-Propanetriyl trihexadecanoate	ChEBI
1,2,3-Propanetriyl trihexadecanoic acid	Generator
1,2,3-trihexadecanoyl-sn-glycerol	biospider
1,2,3-Trihexadecanoylglycerol	ChEBI
2,3-Bis(palmitoyloxy)propyl palmitate	biospider
Barolub	biospider
Barolub LCD	biospider
Dynasan 116	biospider
Dynosan 114	biospider
Glycerin tripalmitate	biospider
Glycerin tripalmitic acid	Generator
Glycerol tripalmitate	db_source
Glycerol tripalmitic acid	Generator
Glyceryl trihexadecanoate	biospider
Glyceryl trihexadecanoic acid	biospider
Glyceryl tripalmitate	biospider
Glyceryl tripalmitic acid	Generator
Hexadecanoate, 1,2,3-propanetriyl ester	Generator
Hexadecanoic acid, 1,1',1''-(1,2,3-propanetriyl) ester	biospider
Hexadecanoic acid, 1,2,3-propanetriyl ester	biospider
Palmitate triglycerin ester	Generator
Palmitic acid triglycerin ester	biospider
Palmitic triglyceride	biospider
Palmitin	db_source
Palmitin, tri-	biospider
Speziafett 116	biospider
Spezialfett 116	biospider
TG 16:0/16:0/16:0	ChEBI
TG(16:0/16:0/16:0)	ChEBI
Triglyceride PPP	biospider
Triglyceryl palmitate	biospider
Triglyceryl palmitic acid	Generator
Trihexadecanoylglycerol	ChEBI
Tripalmitate	biospider
Tripalmitin	biospider
Tripalmitin [inn]	biospider
Tripalmitin or 1,2,3-propanetriyl trihexadecanoate	biospider
Tripalmitin, INN	db_source
Tripalmitoylglycerol	biospider

Chemical Formula

C51H98O6

IUPAC name

1,3-bis(hexadecanoyloxy)propan-2-yl hexadecanoate

InChI Identifier

InChI=1S/C51H98O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-49(52)55-46-48(57-51(54)45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)47-56-50(53)44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h48H,4-47H2,1-3H3

InChI Key

PVNIQBQSYATKKL-UHFFFAOYSA-N

Isomeric SMILES

[H]C(COC(=O)CCCCCCCCCCCCCCC)(COC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCC

Average Molecular Weight

807.3202

Monoisotopic Molecular Weight

806.736340868

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as triacylglycerols. These are glycerides consisting of three fatty acid chains covalently bonded to a glycerol molecule through ester linkages.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Glycerolipids

Sub Class

Triradylcglycerols

Direct Parent

Triacylglycerols

Alternative Parents