Clerod-14-ene-3alpha,4beta,13zeta-triol
TL;DR: Clerod-14-ene-3alpha,4beta,13zeta-triol (CAS 51773-71-8) is a chemical compound with molecular formula C20H38 and molecular weight 278.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,4aR,5R,6S,8aR)-1,5,6,8a-tetramethyl-5-[(3R)-3-methylpentyl]-1,2,3,4,4a,6,7,8-octahydronaphthalene
Also Known As: Neoclerodanes, Clerodanes, CLERODANE, Clerodane Diterpene, Clerodane Diterpenes
| Molecular Formula | C20H38 |
|---|---|
| Molecular Weight | 278.30 g/mol |
| LogP | 8.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.29736 |
| Heavy Atoms | 20 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 51773-71-8 |
|---|---|
| SMILES | CC[C@@H](C)CC[C@@]1([C@H](CC[C@]2([C@H]1CCC[C@@H]2C)C)C)C |
| InChIKey | UKXNCRFTOXSKTE-UHBLESBASA-N |
Product Overview
Clerod-14-ene-3alpha,4beta,13zeta-triol (CAS 51773-71-8), with molecular formula C20H38 and molecular weight 278.30 g/mol. IUPAC: (1S,4aR,5R,6S,8aR)-1,5,6,8a-tetramethyl-5-[(3R)-3-methylpentyl]-1,2,3,4,4a,6,7,8-octahydronaphthalene.
Chemical Property Profile of Clerod-14-ene-3alpha,4beta,13zeta-triol
Property Insights of Clerod-14-ene-3alpha,4beta,13zeta-triol
The XLogP value of 8.6 indicates that Clerod-14-ene-3alpha,4beta,13zeta-triol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Clerod-14-ene-3alpha,4beta,13zeta-triol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Clerod-14-ene-3alpha,4beta,13zeta-triol has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Clerod-14-ene-3alpha,4beta,13zeta-triol?
The CAS number of Clerod-14-ene-3alpha,4beta,13zeta-triol is 51773-71-8.
What is the molecular formula of Clerod-14-ene-3alpha,4beta,13zeta-triol?
The molecular formula of Clerod-14-ene-3alpha,4beta,13zeta-triol is C20H38.
What is the molecular weight of Clerod-14-ene-3alpha,4beta,13zeta-triol?
The molecular weight of Clerod-14-ene-3alpha,4beta,13zeta-triol is 278.30 g/mol.
Where can I buy Clerod-14-ene-3alpha,4beta,13zeta-triol?
You can request a quote for Clerod-14-ene-3alpha,4beta,13zeta-triol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clerod-14-ene-3alpha,4beta,13zeta-triol?
Yes, KEHONG BIO provides custom synthesis services for Clerod-14-ene-3alpha,4beta,13zeta-triol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.