D-Panthothenyl trifarnesylacetate
TL;DR: D-Panthothenyl trifarnesylacetate (CAS 15470-06-1) is a chemical compound with molecular formula C60H97NO7 and molecular weight 943.73 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[(2R)-3,3-dimethyl-2,4-bis[[(4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienoyl]oxy]butanoyl]amino]propyl (4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienoate
Also Known As: Pantothenyl tri(farnesylacetate), D-Panthothenyl trifarnesylacetate, Tri(E,E,E)-5,9,13-trimethyl-4,8,12-tetradecatrienoate, 4,8,12-Tetradecatrienoic acid, 5,9,13-trimethyl-, 1-(((3-((5,9,13-trimethyl-1-oxo-4,8,12-tetradecatrienyl)oxy)propyl)amino)carbonyl)-2,2-dimethyll-1,3-propanediyl ester, (R-(all-E))-, 4,8,12-Tetradecatrienoic acid, 5,9,13-trimethyl-, 1-(((3-((5,9,13-trimethyl-1-oxo-4,8,12-tetradecatrienyl)oxy)propyl)amino)carbonyl)-2,2-dimethyl-1,3-propanediyl ester, (R-(all-E))-
| Molecular Formula | C60H97NO7 |
|---|---|
| Molecular Weight | 943.73 g/mol |
| LogP | 16.1153 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 36 |
| Exact Mass | 943.7265 |
| Heavy Atoms | 68 |
| Complexity | 1796.6394 |
Chemical Identifiers
| CAS Number | 15470-06-1 |
|---|---|
| SMILES | CC(=CCC/C(=C/CC/C(=C/CCC(=O)OCCCNC(=O)[C@@H](C(C)(C)COC(=O)CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)OC(=O)CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)/C)/C)C |
Product Overview
D-Panthothenyl trifarnesylacetate (CAS 15470-06-1), with molecular formula C60H97NO7 and molecular weight 943.73 g/mol. IUPAC: 3-[[(2R)-3,3-dimethyl-2,4-bis[[(4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienoyl]oxy]butanoyl]amino]propyl (4E,8E)-5,9,13-trimethyltetradeca-4,8,12-trienoate.
Chemical Property Profile of D-Panthothenyl trifarnesylacetate
Property Insights of D-Panthothenyl trifarnesylacetate
The XLogP value of 16.1153 indicates that D-Panthothenyl trifarnesylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for D-Panthothenyl trifarnesylacetate. Following Lipinski's Rule of Five, D-Panthothenyl trifarnesylacetate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of D-Panthothenyl trifarnesylacetate?
The CAS number of D-Panthothenyl trifarnesylacetate is 15470-06-1.
What is the molecular formula of D-Panthothenyl trifarnesylacetate?
The molecular formula of D-Panthothenyl trifarnesylacetate is C60H97NO7.
What is the molecular weight of D-Panthothenyl trifarnesylacetate?
The molecular weight of D-Panthothenyl trifarnesylacetate is 943.73 g/mol.
Where can I buy D-Panthothenyl trifarnesylacetate?
You can request a quote for D-Panthothenyl trifarnesylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for D-Panthothenyl trifarnesylacetate?
Yes, KEHONG BIO provides custom synthesis services for D-Panthothenyl trifarnesylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.