Estradiol-3-xyloside
TL;DR: Estradiol-3-xyloside (CAS 134366-08-8) is a chemical compound with molecular formula C23H32O6 and molecular weight 404.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl)oxy]oxane-3,4,5-triol
Also Known As: Estradiol-3-xyloside, ES-3-DL, 17-hydroxyestra-1,3,5(10)-trien-3-yl pentopyranoside, 17-Hydroxyestra-1(10),2,4-trien-3-yl pentopyranoside, 2-[(17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl)oxy]oxane-3,4,5-triol
| Molecular Formula | C23H32O6 |
|---|---|
| Molecular Weight | 404.22 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 99.4 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 404.21988 |
| Heavy Atoms | 29 |
| Complexity | 600.0 |
Chemical Identifiers
| CAS Number | 134366-08-8 |
|---|---|
| SMILES | CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)OC5C(C(C(CO5)O)O)O |
| InChIKey | MTFCFHRFRPNOTN-UHFFFAOYSA-N |
Product Overview
Estradiol-3-xyloside (CAS 134366-08-8), with molecular formula C23H32O6 and molecular weight 404.22 g/mol. IUPAC: 2-[(17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl)oxy]oxane-3,4,5-triol.
Chemical Property Profile of Estradiol-3-xyloside
Property Insights of Estradiol-3-xyloside
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Estradiol-3-xyloside. The TPSA of 99.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Estradiol-3-xyloside. Following Lipinski's Rule of Five, Estradiol-3-xyloside has 4 hydrogen bond donor(s) and 6 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 Estradiol-3-xyloside?
The CAS number of Estradiol-3-xyloside is 134366-08-8.
What is the molecular formula of Estradiol-3-xyloside?
The molecular formula of Estradiol-3-xyloside is C23H32O6.
What is the molecular weight of Estradiol-3-xyloside?
The molecular weight of Estradiol-3-xyloside is 404.22 g/mol.
Where can I buy Estradiol-3-xyloside?
You can request a quote for Estradiol-3-xyloside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Estradiol-3-xyloside?
Yes, KEHONG BIO provides custom synthesis services for Estradiol-3-xyloside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.