6beta-Acetoxyisodrimenin
TL;DR: 6beta-Acetoxyisodrimenin (CAS 74683-13-9) is a chemical compound with molecular formula C17H24O4 and molecular weight 292.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(5R,5aS,9aS)-6,6,9a-trimethyl-1-oxo-4,5,5a,7,8,9-hexahydro-3H-benzo[e][2]benzofuran-5-yl] acetate
Also Known As: 6beta-Acetoxyisodrimenin, Naphtho(1,2-c)furan-1(3H)-one, 5-(acetyloxy)-4,5,5a,6,7,8,9,9a-octahydro-6,6,9a-trimethyl-, (5R-(5alpha,5abeta,9aalpha))-, [(5R,5aS,9aS)-6,6,9a-trimethyl-1-oxo-4,5,5a,7,8,9-hexahydro-3H-benzo[e][2]benzofuran-5-yl] acetate, 6,6,9a-Trimethyl-1-oxo-1,3,4,5,5a,6,7,8,9,9a-decahydronaphtho[1,2-c]furan-5-yl acetate, ((5R,5aS,9aS)-6,6,9a-trimethyl-1-oxo-4,5,5a,7,8,9-hexahydro-3H-benzo(e)(2)benzofuran-5-yl) acetate
| Molecular Formula | C17H24O4 |
|---|---|
| Molecular Weight | 292.17 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.16745 |
| Heavy Atoms | 21 |
| Complexity | 531.0 |
Chemical Identifiers
| CAS Number | 74683-13-9 |
|---|---|
| SMILES | CC(=O)O[C@@H]1CC2=C(C(=O)OC2)[C@@]3([C@@H]1C(CCC3)(C)C)C |
| InChIKey | FNZLTPADJNJFCW-HACGYAERSA-N |
Product Overview
6beta-Acetoxyisodrimenin (CAS 74683-13-9), with molecular formula C17H24O4 and molecular weight 292.17 g/mol. IUPAC: [(5R,5aS,9aS)-6,6,9a-trimethyl-1-oxo-4,5,5a,7,8,9-hexahydro-3H-benzo[e][2]benzofuran-5-yl] acetate.
Chemical Property Profile of 6beta-Acetoxyisodrimenin
Property Insights of 6beta-Acetoxyisodrimenin
The XLogP value of 3.2 indicates that 6beta-Acetoxyisodrimenin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 6beta-Acetoxyisodrimenin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6beta-Acetoxyisodrimenin has 0 hydrogen bond donor(s) and 4 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 6beta-Acetoxyisodrimenin?
The CAS number of 6beta-Acetoxyisodrimenin is 74683-13-9.
What is the molecular formula of 6beta-Acetoxyisodrimenin?
The molecular formula of 6beta-Acetoxyisodrimenin is C17H24O4.
What is the molecular weight of 6beta-Acetoxyisodrimenin?
The molecular weight of 6beta-Acetoxyisodrimenin is 292.17 g/mol.
Where can I buy 6beta-Acetoxyisodrimenin?
You can request a quote for 6beta-Acetoxyisodrimenin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6beta-Acetoxyisodrimenin?
Yes, KEHONG BIO provides custom synthesis services for 6beta-Acetoxyisodrimenin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.