9-cis-RetinylOleate-d17
TL;DR: 9-cis-RetinylOleate-d17 (CAS 79433-57-1) is a chemical compound with molecular formula C38H62O2 and molecular weight 550.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl] octadec-9-enoate
Also Known As: 9-cis-Retinyl Oleate, all-trans-retinyl oleate, 9-cis-RetinylOleate-d17, 9-cis-Retinyl Oleate-d17, [(2E,4E,6Z,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl] (Z)-11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,18-heptadecadeuteriooctadec-9-enoate
| Molecular Formula | C38H62O2 |
|---|---|
| Molecular Weight | 550.48 g/mol |
| LogP | 13.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 22 |
| Exact Mass | 550.475 |
| Heavy Atoms | 40 |
| Complexity | 875.0 |
Chemical Identifiers
| CAS Number | 79433-57-1 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCC(=O)OCC=C(C)C=CC=C(C)C=CC1=C(CCCC1(C)C)C |
| InChIKey | FXKDHZXYYBPLHI-UHFFFAOYSA-N |
Product Overview
9-cis-RetinylOleate-d17 (CAS 79433-57-1), with molecular formula C38H62O2 and molecular weight 550.48 g/mol. IUPAC: [3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenyl] octadec-9-enoate.
Chemical Property Profile of 9-cis-RetinylOleate-d17
Property Insights of 9-cis-RetinylOleate-d17
The XLogP value of 13.7 indicates that 9-cis-RetinylOleate-d17 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 9-cis-RetinylOleate-d17 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-cis-RetinylOleate-d17 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-cis-RetinylOleate-d17?
The CAS number of 9-cis-RetinylOleate-d17 is 79433-57-1.
What is the molecular formula of 9-cis-RetinylOleate-d17?
The molecular formula of 9-cis-RetinylOleate-d17 is C38H62O2.
What is the molecular weight of 9-cis-RetinylOleate-d17?
The molecular weight of 9-cis-RetinylOleate-d17 is 550.48 g/mol.
Where can I buy 9-cis-RetinylOleate-d17?
You can request a quote for 9-cis-RetinylOleate-d17 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-cis-RetinylOleate-d17?
Yes, KEHONG BIO provides custom synthesis services for 9-cis-RetinylOleate-d17 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.