(7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one
TL;DR: (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one (CAS 55056-56-9) is a chemical compound with molecular formula C18H20O3 and molecular weight 284.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,3S,11R,14S,18R)-7-hydroxy-14-methyl-2-oxapentacyclo[9.7.0.01,3.05,10.014,18]octadeca-5(10),6,8-trien-15-one
Also Known As: N,N-Bis-(1-hydroxycylopropyl)-methylamin, (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one, 3-Hydroxy-7,8-epoxyestra-1(10),2,4-trien-17-one, 7,8-Epoxy-3-hydroxyestra-1,3,5 -trien-17-one -, 7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one (7alpha,8alpha)-
| Molecular Formula | C18H20O3 |
|---|---|
| Molecular Weight | 284.14 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 284.14124 |
| Heavy Atoms | 21 |
| Complexity | 503.0 |
Chemical Identifiers
| CAS Number | 55056-56-9 |
|---|---|
| SMILES | C[C@]12CC[C@@H]3C4=C(C[C@H]5[C@]3([C@@H]1CCC2=O)O5)C=C(C=C4)O |
| InChIKey | ZSLZKPBHWAFSRV-SSGTUYFUSA-N |
Product Overview
(7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one (CAS 55056-56-9), with molecular formula C18H20O3 and molecular weight 284.14 g/mol. IUPAC: (1S,3S,11R,14S,18R)-7-hydroxy-14-methyl-2-oxapentacyclo[9.7.0.01,3.05,10.014,18]octadeca-5(10),6,8-trien-15-one.
Chemical Property Profile of (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one
Property Insights of (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one. With a topological polar surface area (TPSA) of 49.8 Ų, (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one has 1 hydrogen bond donor(s) and 3 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 (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one?
The CAS number of (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one is 55056-56-9.
What is the molecular formula of (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one?
The molecular formula of (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one is C18H20O3.
What is the molecular weight of (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one?
The molecular weight of (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one is 284.14 g/mol.
Where can I buy (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one?
You can request a quote for (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one?
Yes, KEHONG BIO provides custom synthesis services for (7alpha,8alpha)-7,8-Epoxy-3-hydroxyestra-1,3,5(10)-trien-17-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.