Phorbol 13,20-diacetate
TL;DR: Phorbol 13,20-diacetate (CAS 54082-68-7) is a chemical compound with molecular formula C24H32O8 and molecular weight 448.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2S,6R,10S,11R,13S,14R,15R)-13-acetyloxy-1,6,14-trihydroxy-4,12,12,15-tetramethyl-5-oxo-8-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl]methyl acetate
Also Known As: phorbol diacetate, Phorbol 13,20-diacetate, Phorbol-12,13-diacetat, PHORBOL-13,20-DIACETATE, PHORBOL13,20-DIACETATE
| Molecular Formula | C24H32O8 |
|---|---|
| Molecular Weight | 448.21 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.20972 |
| Heavy Atoms | 32 |
| Complexity | 963.0 |
Chemical Identifiers
| CAS Number | 54082-68-7 |
|---|---|
| SMILES | C[C@@H]1[C@H]([C@@]2([C@@H](C2(C)C)[C@H]3[C@]1([C@@H]4C=C(C(=O)[C@]4(CC(=C3)COC(=O)C)O)C)O)OC(=O)C)O |
| InChIKey | VCQRVYCLJARKLE-XQOWHXTBSA-N |
Product Overview
Phorbol 13,20-diacetate (CAS 54082-68-7), with molecular formula C24H32O8 and molecular weight 448.21 g/mol. IUPAC: [(1S,2S,6R,10S,11R,13S,14R,15R)-13-acetyloxy-1,6,14-trihydroxy-4,12,12,15-tetramethyl-5-oxo-8-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl]methyl acetate.
Chemical Property Profile of Phorbol 13,20-diacetate
Property Insights of Phorbol 13,20-diacetate
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phorbol 13,20-diacetate. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phorbol 13,20-diacetate. Following Lipinski's Rule of Five, Phorbol 13,20-diacetate has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phorbol 13,20-diacetate?
The CAS number of Phorbol 13,20-diacetate is 54082-68-7.
What is the molecular formula of Phorbol 13,20-diacetate?
The molecular formula of Phorbol 13,20-diacetate is C24H32O8.
What is the molecular weight of Phorbol 13,20-diacetate?
The molecular weight of Phorbol 13,20-diacetate is 448.21 g/mol.
Where can I buy Phorbol 13,20-diacetate?
You can request a quote for Phorbol 13,20-diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phorbol 13,20-diacetate?
Yes, KEHONG BIO provides custom synthesis services for Phorbol 13,20-diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.