Epitaondiol
TL;DR: Epitaondiol (CAS 75598-52-6) is a chemical compound with molecular formula C27H40O3 and molecular weight 412.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2R,11S,14R,15R,18S,20R)-1,8,11,15,19,19-hexamethyl-10-oxapentacyclo[12.8.0.02,11.04,9.015,20]docosa-4(9),5,7-triene-6,18-diol
Also Known As: Epitaondiol, (1R,2R,11S,14R,15R,18S,20R)-1,8,11,15,19,19-hexamethyl-10-oxapentacyclo[12.8.0.02,11.04,9.015,20]docosa-4(9),5,7-triene-6,18-diol, (14beta)-4,4,8-Trimethyl-16,24-cyclo-D(17a)-homo-17a-oxa-5alpha-chola-16,20(22),23-triene-3beta,23-diol, (1R,2R,11S,14R,15R,18S,20R)-1,8,11,15,19,19-hexamethyl-10-oxapentacyclo(12.8.0.02,11.04,9.015,20)docosa-4(9),5,7-triene-6,18-diol, (2S,4aR,4bR,6aS,12aR,12bR,14aR)-1,1,4a,6a,8,12b-hexamethyl-1H,2H,3H,4H,4aH,4bH,5H,6H,6aH,12H,12aH,12bH,13H,14H,14aH-naphtho[2,1-a]xanthene-2,10-diol
| Molecular Formula | C27H40O3 |
|---|---|
| Molecular Weight | 412.30 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 412.29776 |
| Heavy Atoms | 30 |
| Complexity | 690.0 |
Chemical Identifiers
| CAS Number | 75598-52-6 |
|---|---|
| SMILES | CC1=CC(=CC2=C1O[C@]3(CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@H]3C2)C)(C)C)O)C)C)O |
| InChIKey | LRMHPGVONLYGQD-GGQWBCBCSA-N |
Product Overview
Epitaondiol (CAS 75598-52-6), with molecular formula C27H40O3 and molecular weight 412.30 g/mol. IUPAC: (1R,2R,11S,14R,15R,18S,20R)-1,8,11,15,19,19-hexamethyl-10-oxapentacyclo[12.8.0.02,11.04,9.015,20]docosa-4(9),5,7-triene-6,18-diol.
Chemical Property Profile of Epitaondiol
Property Insights of Epitaondiol
The XLogP value of 6.7 indicates that Epitaondiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, Epitaondiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Epitaondiol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Epitaondiol?
The CAS number of Epitaondiol is 75598-52-6.
What is the molecular formula of Epitaondiol?
The molecular formula of Epitaondiol is C27H40O3.
What is the molecular weight of Epitaondiol?
The molecular weight of Epitaondiol is 412.30 g/mol.
Where can I buy Epitaondiol?
You can request a quote for Epitaondiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Epitaondiol?
Yes, KEHONG BIO provides custom synthesis services for Epitaondiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.