Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide
TL;DR: Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide (CAS 77431-57-3) is a chemical compound with molecular formula C35H34N2O7 and molecular weight 594.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9,21-dimethoxy-16-methyl-16-oxido-7,24,34-trioxa-31-aza-16-azoniaoctacyclo[20.9.3.23,6.115,19.08,13.025,33.028,32.023,35]heptatriaconta-3(37),4,6(36),8(13),9,11,19,21,23(35),25,27,32-dodecaen-26-ol
Also Known As: Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide, OXYACANTHAN-6-OL,7,8-EPOXY-6,12-DIMETHOXY-2-METHYL-,2-OXIDE
| Molecular Formula | C35H34N2O7 |
|---|---|
| Molecular Weight | 594.24 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 96.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 594.2366 |
| Heavy Atoms | 44 |
| Complexity | 1010.0 |
Chemical Identifiers
| CAS Number | 77431-57-3 |
|---|---|
| SMILES | C[N+]1(CCC2=CC(=C3C4=C2C1CC5=C(C(=CC=C5)OC)OC6=CC=C(CC7C8=C(O3)C(=C(C=C8CCN7)O)O4)C=C6)OC)[O-] |
| InChIKey | HGRAEPFBYAUSIV-UHFFFAOYSA-N |
Product Overview
Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide (CAS 77431-57-3), with molecular formula C35H34N2O7 and molecular weight 594.24 g/mol. IUPAC: 9,21-dimethoxy-16-methyl-16-oxido-7,24,34-trioxa-31-aza-16-azoniaoctacyclo[20.9.3.23,6.115,19.08,13.025,33.028,32.023,35]heptatriaconta-3(37),4,6(36),8(13),9,11,19,21,23(35),25,27,32-dodecaen-26-ol.
Chemical Property Profile of Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide
Property Insights of Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide
The XLogP value of 5.0 indicates that Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide. Following Lipinski's Rule of Five, Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide?
The CAS number of Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide is 77431-57-3.
What is the molecular formula of Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide?
The molecular formula of Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide is C35H34N2O7.
What is the molecular weight of Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide?
The molecular weight of Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide is 594.24 g/mol.
Where can I buy Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide?
You can request a quote for Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide?
Yes, KEHONG BIO provides custom synthesis services for Oxyacanthan-6-ol, 7,8'-epoxy-6',12'-dimethoxy-2'-methyl-, 2'-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.