12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate
TL;DR: 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate (CAS 69883-99-4) is a chemical compound with molecular formula C32H38O9 and molecular weight 566.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[8-(acetyloxymethyl)-1,6-dihydroxy-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] 2-(4-acetyloxyphenyl)acetate
Also Known As: 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate, 5H-Cyclopropa(3,4)benz(1,2-e)azulen-5-one, 1,1a-alpha,1b-beta,4,4a,7a-alpha,7b,8,9,9a-decahydro-4a-beta,7b-alpha,9a-alpha-trihydroxy-3-(hydroxymethyl)-1,1,6,8-alpha-tetramethyl-, 3-acetate 9a-(4-acetoxyphenylacetate), 3-[(Acetyloxy)methyl]-4a,7b-dihydroxy-1,1,6,8-tetramethyl-5-oxo-1,1a,1b,4,4a,5,7a,7b,8,9-decahydro-9aH-cyclopropa[3,4]benzo[1,2-e]azulen-9a-yl [4-(acetyloxy)phenyl]acetate
| Molecular Formula | C32H38O9 |
|---|---|
| Molecular Weight | 566.25 g/mol |
| LogP | 3.249 |
| Topological Polar Surface Area | 136.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 566.2516 |
| Heavy Atoms | 41 |
| Complexity | 1371.6743 |
Chemical Identifiers
| CAS Number | 69883-99-4 |
|---|---|
| SMILES | CC1CC2(C(C2(C)C)C3C1(C4C=C(C(=O)C4(CC(=C3)COC(=O)C)O)C)O)OC(=O)CC5=CC=C(C=C5)OC(=O)C |
Product Overview
12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate (CAS 69883-99-4), with molecular formula C32H38O9 and molecular weight 566.25 g/mol. IUPAC: [8-(acetyloxymethyl)-1,6-dihydroxy-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] 2-(4-acetyloxyphenyl)acetate.
Chemical Property Profile of 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate
Property Insights of 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate
The XLogP value of 3.249 indicates that 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 136.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate. Following Lipinski's Rule of Five, 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate has 2 hydrogen bond donor(s) and 9 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-(4-acetoxyphenylacetate)-20-acetate?
The CAS number of 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate is 69883-99-4.
What is the molecular formula of 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate?
The molecular formula of 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate is C32H38O9.
What is the molecular weight of 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate?
The molecular weight of 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate is 566.25 g/mol.
Where can I buy 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate?
You can request a quote for 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate 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-(4-acetoxyphenylacetate)-20-acetate?
Yes, KEHONG BIO provides custom synthesis services for 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.