12-Deoxyphorbol 13-palmitate
TL;DR: 12-Deoxyphorbol 13-palmitate (CAS 66583-59-3) is a chemical compound with molecular formula C36H58O6 and molecular weight 586.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,2S,6R,10S,11R,13S,15R)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] hexadecanoate
Also Known As: 12-Deoxyphorbol 13-palmitate, Baliospermum axillare, 12-deoxyphorbol-13-hexadecanoate, 12-deoxyphorbol-13-palmitate, PHORBOL,12-DEOXY- 13-PALMITATE B807430K057
| Molecular Formula | C36H58O6 |
|---|---|
| Molecular Weight | 586.42 g/mol |
| LogP | 8.0 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 17 |
| Exact Mass | 586.42334 |
| Heavy Atoms | 42 |
| Complexity | 1040.0 |
Chemical Identifiers
| CAS Number | 66583-59-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)O[C@@]12C[C@H]([C@]3([C@H]([C@@H]1C2(C)C)C=C(C[C@]4([C@H]3C=C(C4=O)C)O)CO)O)C |
| InChIKey | QUVRUINWOFZNJL-IEIRSVMLSA-N |
Product Overview
12-Deoxyphorbol 13-palmitate (CAS 66583-59-3), with molecular formula C36H58O6 and molecular weight 586.42 g/mol. IUPAC: [(1R,2S,6R,10S,11R,13S,15R)-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] hexadecanoate.
Chemical Property Profile of 12-Deoxyphorbol 13-palmitate
Property Insights of 12-Deoxyphorbol 13-palmitate
The XLogP value of 8.0 indicates that 12-Deoxyphorbol 13-palmitate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 12-Deoxyphorbol 13-palmitate. Following Lipinski's Rule of Five, 12-Deoxyphorbol 13-palmitate has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 12-Deoxyphorbol 13-palmitate?
The CAS number of 12-Deoxyphorbol 13-palmitate is 66583-59-3.
What is the molecular formula of 12-Deoxyphorbol 13-palmitate?
The molecular formula of 12-Deoxyphorbol 13-palmitate is C36H58O6.
What is the molecular weight of 12-Deoxyphorbol 13-palmitate?
The molecular weight of 12-Deoxyphorbol 13-palmitate is 586.42 g/mol.
Where can I buy 12-Deoxyphorbol 13-palmitate?
You can request a quote for 12-Deoxyphorbol 13-palmitate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 12-Deoxyphorbol 13-palmitate?
Yes, KEHONG BIO provides custom synthesis services for 12-Deoxyphorbol 13-palmitate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.