Microstegiol
TL;DR: Microstegiol (CAS 143246-41-7) is a chemical compound with molecular formula C20H26O2 and molecular weight 298.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S)-1-hydroxy-8,13,13-trimethyl-3-propan-2-yltricyclo[7.4.1.05,14]tetradeca-3,5(14),6,8-tetraen-2-one
Also Known As: microstegiol, HY-N10689, (1S)-1-hydroxy-8,13,13-trimethyl-3-propan-2-yltricyclo[7.4.1.05,14]tetradeca-3,5(14),6,8-tetraen-2-one, (10aS)-2-Isopropyl-6,10,10-trimethyl-10a-hydroxy-7,8,9,10-tetrahydrocyclohepta[de]naphthalene-1(10aH)-one, (1S)-1-hydroxy-8,13,13-trimethyl-3-(propan-2-yl)tricyclo[7.4.1.05,14]tetradeca-3,5,7,9(14)-tetraen-2-one
| Molecular Formula | C20H26O2 |
|---|---|
| Molecular Weight | 298.19 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 298.19327 |
| Heavy Atoms | 22 |
| Complexity | 502.0 |
Chemical Identifiers
| CAS Number | 143246-41-7 |
|---|---|
| SMILES | CC1=C2CCCC([C@@]3(C2=C(C=C1)C=C(C3=O)C(C)C)O)(C)C |
| InChIKey | KIXMQGXACFNMEM-FQEVSTJZSA-N |
Product Overview
Microstegiol (CAS 143246-41-7), with molecular formula C20H26O2 and molecular weight 298.19 g/mol. IUPAC: (1S)-1-hydroxy-8,13,13-trimethyl-3-propan-2-yltricyclo[7.4.1.05,14]tetradeca-3,5(14),6,8-tetraen-2-one.
Chemical Property Profile of Microstegiol
Property Insights of Microstegiol
The XLogP value of 4.8 indicates that Microstegiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Microstegiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Microstegiol has 1 hydrogen bond donor(s) and 2 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 Microstegiol?
The CAS number of Microstegiol is 143246-41-7.
What is the molecular formula of Microstegiol?
The molecular formula of Microstegiol is C20H26O2.
What is the molecular weight of Microstegiol?
The molecular weight of Microstegiol is 298.19 g/mol.
Where can I buy Microstegiol?
You can request a quote for Microstegiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Microstegiol?
Yes, KEHONG BIO provides custom synthesis services for Microstegiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.