tricaproin (CHEBI:77386)

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ChEBI Name	tricaproin

ChEBI ID	CHEBI:77386

Definition	A triglyceride obtained by condensation of each of the three hydroxy groups of glycerol with hexanoic (caproic) acid.

Stars	This entity has been manually annotated by the ChEBI Team.

Submitter	laimo

Supplier Information

Download	Molfile XML SDF

Formula

C21H38O6

Net Charge

Average Mass

386.52280

Monoisotopic Mass

386.26684

InChI

InChI=1S/C21H38O6/c1-4-7-10-13-19(22)25-16-18(27-21(24)15-12-9-6-3)17-26-20(23)14-11-8-5-2/h18H,4-17H2,1-3H3

InChIKey

MAYCICSNZYXLHB-UHFFFAOYSA-N

SMILES

CCCCCC(=O)OCC(COC(=O)CCCCC)OC(=O)CCCCC

Roles Classification
Application(s):	insect repellent An insecticide that acts as a repellent to insects.

ChEBI Ontology
Outgoing	tricaproin (CHEBI:77386) has role insect repellent (CHEBI:71692) tricaproin (CHEBI:77386) is a hexanoate ester (CHEBI:87656) tricaproin (CHEBI:77386) is a triglyceride (CHEBI:17855)

IUPAC Name

propane-1,2,3-triyl trihexanoate

Synonyms	Sources
1,2,3-Propanetriyl hexanoate	HMDB
1,2,3-Tricaproylglycerol	HMDB
1,2,3-trihexanoylglycerol	SUBMITTER
Caproic triglyceride	ChemIDplus
Glycerol tricaproate	ChemIDplus
Glycerol tricapronate	HMDB
Glycerol trihexanoate	NIST Chemistry WebBook
Glyceryl tricaproate	ChemIDplus
Hexanoic acid, 1,2,3-propanetriyl ester	ChemIDplus
propane-1,2,3-triyl tricaproate	ChEBI
TG 6:0/6:0/6:0	SUBMITTER
Tricaproylglycerol	ChemIDplus
Trihexanoin	NIST Chemistry WebBook
Trihexanoyl glycerol	ChemIDplus
trihexanoylglycerol	UniProt

Last Modified

04 September 2015