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| Synonyms | Tricaprin | 621-71-6 | Tridecanoin | Glycerol tridecanoate | Glyceryl tridecanoate | Glycerol tricaprate | Decanoin, tri- | Glyceryl tricaprate | Tricapric glyceride | Capric acid triglyceride | Glycerol tricaprin | 1,2,3-Tridecanoylglycerol | Dynasan 110 | Decanoic acid, 1,2,3-pr |
|---|---|
| Specifications & Purity | 10mM in DMSO |
| Storage Temp | Store at -80°C |
| Shipped In |
Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available. |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Lipids and lipid-like molecules |
| Class | Glycerolipids |
| Subclass | Triradylcglycerols |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Triacylglycerols |
| Alternative Parents | Tricarboxylic acids and derivatives Fatty acid esters Carboxylic acid esters Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Triacyl-sn-glycerol - Tricarboxylic acid or derivatives - Fatty acid ester - Fatty acyl - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound |
| Description | This compound 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. |
| External Descriptors | Triacylglycerols |
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| IUPAC Name | 2,3-di(decanoyloxy)propyl decanoate |
|---|---|
| INCHI | InChI=1S/C33H62O6/c1-4-7-10-13-16-19-22-25-31(34)37-28-30(39-33(36)27-24-21-18-15-12-9-6-3)29-38-32(35)26-23-20-17-14-11-8-5-2/h30H,4-29H2,1-3H3 |
| InChIKey | LADGBHLMCUINGV-UHFFFAOYSA-N |
| Smiles | CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC)OC(=O)CCCCCCCCC |
| Isomeric SMILES | CCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCC)OC(=O)CCCCCCCCC |
| WGK Germany | 1 |
| RTECS | HE0100000 |
| PubChem CID | 69310 |
| Molecular Weight | 554.85 |
| Reaxy-Rn | 1717683 |
| Sensitivity | heat sensitive |
|---|---|
| Boil Point(°C) | 254 °C/5 mmHg |
| Melt Point(°C) | 32 °C |
| Molecular Weight | 554.800 g/mol |
| XLogP3 | 12.200 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 32 |
| Exact Mass | 554.455 Da |
| Monoisotopic Mass | 554.455 Da |
| Topological Polar Surface Area | 78.900 Ų |
| Heavy Atom Count | 39 |
| Formal Charge | 0 |
| Complexity | 543.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Yao Zuo, Hongwen Li, Xiaochao Wang, Yejin Liang, Caihong Huang, Guanye Nai, Jingrong Ruan, Wenzheng Dong, Xiang Lu. (2024) Inhibition of JAK/STAT3 Expression by Acute Myeloid Leukemia-Targeted Nanoliposome for Chemotherapy Enhancement. ACS Omega, 9 (36): (37901-37909). |