Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside
TL;DR: Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside (CAS 13389-14-5) is a chemical compound with molecular formula C27H42O6 and molecular weight 462.29813 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,3R,4S,5R,6R)-2-[[(10R,13R,17R)-17-ethenyl-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: KST-1A1138, Pregna-5,20-dien-3-yl hexopyranoside, Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside, (8xi,9xi,14xi)-pregna-5,20-dien-3-yl, A-d-galactopyranoside
Technical Specifications
| Molecular Formula | C27H42O6 |
| Molecular Weight | 462.29813 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 99.4 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 462.29813 Da |
| Heavy Atoms | 33 |
| Complexity | 783.0 |
| SMILES | C[C@]12CCC3C(C1CC[C@@H]2C=C)CC=C4[C@@]3(CCC(C4)O[C@H]5[C@@H]([C@H]([C@H]([C@H](O5)CO)O)O)O)C |
| InChIKey | IUHXQFZAXDVYTB-SXEWAFQNSA-N |
Chemical Property Profile of Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside
Property Insights of Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside
The XLogP value of 3.8 indicates that Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside. Following Lipinski's Rule of Five, Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside 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
What is the CAS number of Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside?
The CAS number of Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside is 13389-14-5.
What is the molecular formula of Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside?
The molecular formula of Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside is C27H42O6.
What is the molecular weight of Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside?
The molecular weight of Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside is 462.29813 g/mol.
Where can I buy Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside?
You can request a quote for Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside?
Yes, CoreyChem provides custom synthesis services for Pregna-5,20-dien-3beta-yl beta-D-galactopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.