6-epi-Shyobunol
TL;DR: 6-epi-Shyobunol (CAS 35727-45-8) is a chemical compound with molecular formula C15H26O and molecular weight 222.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethenyl-3-methyl-6-propan-2-yl-2-prop-1-en-2-ylcyclohexan-1-ol
Also Known As: Shyobunol, 6-epi-Shyobunol, elema-1,3-dien-6.alpha.-ol, 3-ethenyl-3-methyl-6-propan-2-yl-2-prop-1-en-2-ylcyclohexan-1-ol, 3-ethenyl-3-methyl-2-(prop-1-en-2-yl)-6-(propan-2-yl)cyclohexan-1-ol
| Molecular Formula | C15H26O |
|---|---|
| Molecular Weight | 222.20 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.19836 |
| Heavy Atoms | 16 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 35727-45-8 |
|---|---|
| SMILES | CC(C)C1CCC(C(C1O)C(=C)C)(C)C=C |
| InChIKey | WOULTTPZJDSDEI-UHFFFAOYSA-N |
Product Overview
6-epi-Shyobunol (CAS 35727-45-8), with molecular formula C15H26O and molecular weight 222.20 g/mol. IUPAC: 3-ethenyl-3-methyl-6-propan-2-yl-2-prop-1-en-2-ylcyclohexan-1-ol.
Chemical Property Profile of 6-epi-Shyobunol
Property Insights of 6-epi-Shyobunol
The XLogP value of 4.8 indicates that 6-epi-Shyobunol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 6-epi-Shyobunol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-epi-Shyobunol has 1 hydrogen bond donor(s) and 1 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 6-epi-Shyobunol?
The CAS number of 6-epi-Shyobunol is 35727-45-8.
What is the molecular formula of 6-epi-Shyobunol?
The molecular formula of 6-epi-Shyobunol is C15H26O.
What is the molecular weight of 6-epi-Shyobunol?
The molecular weight of 6-epi-Shyobunol is 222.20 g/mol.
Where can I buy 6-epi-Shyobunol?
You can request a quote for 6-epi-Shyobunol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-epi-Shyobunol?
Yes, KEHONG BIO provides custom synthesis services for 6-epi-Shyobunol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.