(9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside
TL;DR: (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside (CAS 60796-63-6) is a chemical compound with molecular formula C35H60O6 and molecular weight 576.44 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5S,6R)-2-[[(10S,13R,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: Schottenol glucoside, Stigma-7-en-3beta-glucoside, Stigmast-7-en-3-yl hexopyranoside, (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside, (2R,3R,4S,5R,6R)-2-[[(10R,13S,17R)-17-[(2R,5R)-5-ethyl-6-methyl-heptan-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
| Molecular Formula | C35H60O6 |
|---|---|
| Molecular Weight | 576.44 g/mol |
| LogP | 7.5 |
| Topological Polar Surface Area | 99.4 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 576.43896 |
| Heavy Atoms | 41 |
| Complexity | 920.0 |
Chemical Identifiers
| CAS Number | 60796-63-6 |
|---|---|
| SMILES | CC[C@H](CC[C@@H](C)[C@H]1CCC2[C@@]1(CCC3C2=CCC4[C@@]3(CCC(C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)C)C)C(C)C |
| InChIKey | XWPUVGRUJWXYTP-MNLIYSCFSA-N |
Product Overview
(9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside (CAS 60796-63-6), with molecular formula C35H60O6 and molecular weight 576.44 g/mol. IUPAC: (2R,3R,4S,5S,6R)-2-[[(10S,13R,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside
Property Insights of (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside
The XLogP value of 7.5 indicates that (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside 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 (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside. Following Lipinski's Rule of Five, (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside?
The CAS number of (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside is 60796-63-6.
What is the molecular formula of (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside?
The molecular formula of (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside is C35H60O6.
What is the molecular weight of (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside?
The molecular weight of (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside is 576.44 g/mol.
Where can I buy (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside?
You can request a quote for (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside?
Yes, KEHONG BIO provides custom synthesis services for (9xi,14xi)-Stigmast-7-en-3-yl beta-D-glucopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.