CTK3I8130
TL;DR: CTK3I8130 (CAS 98496-36-7) is a chemical compound with molecular formula C22H34O2 and molecular weight 330.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3R,3aS,11S,12aR)-6,10,12a-trimethyl-3-prop-1-en-2-yl-2,3,3a,4,7,8,11,12-octahydro-1H-cyclopenta[11]annulen-11-yl] acetate
Also Known As: [(1R,3S,4Z,8Z,11S,12R)-1,4,8-trimethyl-12-prop-1-en-2-yl-3-bicyclo[9.3.0]tetradeca-4,8-dienyl] acetate|5-Cyclopentacycloundecenol, 1,2,3,3a,4,5,8,9,12,12a-decahydro-3a,6,10-trimethyl-1-(1-methylethenyl)-, acetate, (1R-(1R*,3aR*,5s*,6E,10E,12aS*))-
| Molecular Formula | C22H34O2 |
|---|---|
| Molecular Weight | 330.26 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.2559 |
| Heavy Atoms | 24 |
| Complexity | 554.0 |
Chemical Identifiers
| CAS Number | 98496-36-7 |
|---|---|
| SMILES | CC1=CC[C@H]2[C@@H](CC[C@@]2(C[C@@H](C(=CCC1)C)OC(=O)C)C)C(=C)C |
| InChIKey | JEYVZBRIYHCFEG-MYGLTJDJSA-N |
Product Overview
CTK3I8130 (CAS 98496-36-7), with molecular formula C22H34O2 and molecular weight 330.26 g/mol. IUPAC: [(3R,3aS,11S,12aR)-6,10,12a-trimethyl-3-prop-1-en-2-yl-2,3,3a,4,7,8,11,12-octahydro-1H-cyclopenta[11]annulen-11-yl] acetate.
Chemical Property Profile of CTK3I8130
Property Insights of CTK3I8130
The XLogP value of 5.7 indicates that CTK3I8130 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, CTK3I8130 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CTK3I8130 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK3I8130?
The CAS number of CTK3I8130 is 98496-36-7.
What is the molecular formula of CTK3I8130?
The molecular formula of CTK3I8130 is C22H34O2.
What is the molecular weight of CTK3I8130?
The molecular weight of CTK3I8130 is 330.26 g/mol.
Where can I buy CTK3I8130?
You can request a quote for CTK3I8130 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK3I8130?
Yes, KEHONG BIO provides custom synthesis services for CTK3I8130 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.