17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯
TL;DR: 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯 (CAS 6693-10-3) is a chemical compound with molecular formula C18H24O5S and molecular weight 352.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯
(17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) hydrogen sulfate
Also Known As: Estradiol 17 sulfate, ESTRADIOL 3-SULFATE, 17-hydroxyestra-1,3,5(10)-trien-3-yl hydrogen sulfate, (17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) hydrogen sulfate, 17-hydroxy-13-methyl-3-sulfooxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene
| Molecular Formula | C18H24O5S |
|---|---|
| Molecular Weight | 352.13 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 92.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 352.13443 |
| Heavy Atoms | 24 |
| Complexity | 585.0 |
Chemical Identifiers
| CAS Number | 6693-10-3 |
|---|---|
| SMILES | CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)OS(=O)(=O)O |
| InChIKey | QZIGLSSUDXBTLJ-UHFFFAOYSA-N |
Product Overview
17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯 (CAS 6693-10-3), with molecular formula C18H24O5S and molecular weight 352.13 g/mol. IUPAC: (17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl) hydrogen sulfate.
Chemical Property Profile of 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯
Property Insights of 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯. The TPSA of 92.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯. Following Lipinski's Rule of Five, 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯 has 2 hydrogen bond donor(s) and 5 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 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯?
The CAS number of 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯 is 6693-10-3.
What is the molecular formula of 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯?
The molecular formula of 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯 is C18H24O5S.
What is the molecular weight of 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯?
The molecular weight of 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯 is 352.13 g/mol.
Where can I buy 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯?
You can request a quote for 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯?
Yes, KEHONG BIO provides custom synthesis services for 17-羟基雌-1,3,5(10)-三烯-3-基硫酸氢酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.