Euphorbin E
TL;DR: Euphorbin E (CAS 126239-93-8) is a chemical compound with molecular formula C33H42O8 and molecular weight 566.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1S,2S,3aE,5S,6E,9R,11R,12E)-4,9-diacetyloxy-1-benzoyloxy-2,5,8,8,12-pentamethyl-1,2,3,5,9,10,11,13a-octahydrocyclopenta[12]annulene-11-carboxylate
Also Known As: Euphorbin E, 1H-Cyclopentacyclododecene-1,4,9,11-tetrol, 2,3,5,8,9,10,11,13a-octahydro-2,5,8,8,12-pentamethyl-, 4,9,11-triacetate 1-benzoate, (1S,2S,3aE,5S,6E,9R,11R,12E,13aR)-, methyl (1S,2S,3aE,5S,6E,9R,11R,12E)-4,9-diacetoxy-1-benzoyloxy-2,5,8,8,12-pentamethyl-1,2,3,5,9,10,11,13a-octahydrocyclopenta[12]annulene-11-carboxylate, methyl (1S,2S,3aE,5S,6E,9R,11R,12E)-4,9-diacetyloxy-1-benzoyloxy-2,5,8,8,12-pentamethyl-1,2,3,5,9,10,11,13a-octahydrocyclopenta(12)annulene-11-carboxylate, methyl (1S,2S,3aE,5S,6E,9R,11R,12E)-4,9-diacetyloxy-1-benzoyloxy-2,5,8,8,12-pentamethyl-1,2,3,5,9,10,11,13a-octahydrocyclopenta[12]annulene-11-carboxylate
| Molecular Formula | C33H42O8 |
|---|---|
| Molecular Weight | 566.29 g/mol |
| LogP | 5.9746 |
| Topological Polar Surface Area | 105.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 566.28796 |
| Heavy Atoms | 41 |
| Complexity | 1238.9423 |
Chemical Identifiers
| CAS Number | 126239-93-8 |
|---|---|
| SMILES | C[C@H]1C/C/2=C(/[C@H](/C=C/C([C@@H](C[C@H](/C(=C/C2[C@H]1OC(=O)C3=CC=CC=C3)/C)C(=O)OC)OC(=O)C)(C)C)C)\OC(=O)C |
Product Overview
Euphorbin E (CAS 126239-93-8), with molecular formula C33H42O8 and molecular weight 566.29 g/mol. IUPAC: methyl (1S,2S,3aE,5S,6E,9R,11R,12E)-4,9-diacetyloxy-1-benzoyloxy-2,5,8,8,12-pentamethyl-1,2,3,5,9,10,11,13a-octahydrocyclopenta[12]annulene-11-carboxylate.
Chemical Property Profile of Euphorbin E
Property Insights of Euphorbin E
The XLogP value of 5.9746 indicates that Euphorbin E is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Euphorbin E. Following Lipinski's Rule of Five, Euphorbin E has 0 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 Euphorbin E?
The CAS number of Euphorbin E is 126239-93-8.
What is the molecular formula of Euphorbin E?
The molecular formula of Euphorbin E is C33H42O8.
What is the molecular weight of Euphorbin E?
The molecular weight of Euphorbin E is 566.29 g/mol.
Where can I buy Euphorbin E?
You can request a quote for Euphorbin E directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Euphorbin E?
Yes, KEHONG BIO provides custom synthesis services for Euphorbin E and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.