佛波醇-12-肉豆蔻酸-13-乙酸酯
TL;DR: 佛波醇-12-肉豆蔻酸-13-乙酸酯 (CAS 16561-29-8) is a chemical compound with molecular formula C36H56O8 and molecular weight 616.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
佛波醇-12-肉豆蔻酸-13-乙酸酯
[13-acetyloxy-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] tetradecanoate
Also Known As: Phorbol myristate acetate, Phorbol ester, Factor A1, Phorbol acetate, myristate, Phorbol 12-myristate 13-acetate
| Molecular Formula | C36H56O8 |
|---|---|
| Molecular Weight | 616.40 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 17 |
| Exact Mass | 616.3975 |
| Heavy Atoms | 44 |
| Complexity | 1150.0 |
Chemical Identifiers
| CAS Number | 16561-29-8 |
|---|---|
| SMILES | CCCCCCCCCCCCCC(=O)OC1C(C2(C(C=C(CC3(C2C=C(C3=O)C)O)CO)C4C1(C4(C)C)OC(=O)C)O)C |
| InChIKey | PHEDXBVPIONUQT-UHFFFAOYSA-N |
Product Overview
佛波醇-12-肉豆蔻酸-13-乙酸酯 (CAS 16561-29-8), with molecular formula C36H56O8 and molecular weight 616.40 g/mol. IUPAC: [13-acetyloxy-1,6-dihydroxy-8-(hydroxymethyl)-4,12,12,15-tetramethyl-5-oxo-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] tetradecanoate.
Chemical Property Profile of 佛波醇-12-肉豆蔻酸-13-乙酸酯
Property Insights of 佛波醇-12-肉豆蔻酸-13-乙酸酯
The XLogP value of 6.5 indicates that 巴豆醇-12-十四烷酸酯-13-乙酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 佛波醇-12-肉豆蔻酸-13-乙酸酯. Following Lipinski's Rule of Five, 巴豆醇-12-十四烷酸酯-13-乙酸酯 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 巴豆醇-12-十四烷酸酯-13-乙酸酯?
The CAS number of 巴豆醇-12-十四烷酸酯-13-乙酸酯 is 16561-29-8.
What is the molecular formula of 巴豆醇-12-十四烷酸酯-13-乙酸酯?
The molecular formula of 巴豆醇-12-十四烷酸酯-13-乙酸酯 is C36H56O8.
What is the molecular weight of 巴豆醇-12-十四烷酸酯-13-乙酸酯?
The molecular weight of 巴豆醇-12-十四烷酸酯-13-乙酸酯 is 616.40 g/mol.
Where can I buy 巴豆醇-12-十四烷酸酯-13-乙酸酯?
You can request a quote for 巴豆醇-12-十四烷酸酯-13-乙酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 巴豆醇-12-十四烷酸酯-13-乙酸酯?
Yes, KEHONG BIO provides custom synthesis services for 巴豆醇-12-十四烷酸酯-13-乙酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.