TGL

TRISTEAROYLGLYCEROL

Created:	2003-12-02
Last modified:	2021-03-01

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Chemical Details
Formal Charge	0
Atom Count	173
Chiral Atom Count	0
Bond Count	172
Aromatic Bond Count	0

2D diagram of TGL

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Chemical Component Summary
Name	TRISTEAROYLGLYCEROL
Synonyms	TRIACYLGLYCEROL
Systematic Name (OpenEye OEToolkits)	2,3-di(octadecanoyloxy)propyl octadecanoate
Formula	C₅₇ H₁₁₀ O₆
Molecular Weight	891.48
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	O=C(OCC(OC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCC
SMILES	CACTVS	3.341	CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC
SMILES	OpenEye OEToolkits	1.5.0	CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC
Canonical SMILES	CACTVS	3.341	CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC
Canonical SMILES	OpenEye OEToolkits	1.5.0	CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCCCC
InChI	InChI	1.03	InChI=1S/C57H110O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h54H,4-53H2,1-3H3
InChIKey	InChI	1.03	DCXXMTOCNZCJGO-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	11146
ChEBI	CHEBI:45956
COD	2103656

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