24-Acetylhydroshengmanol xyloside
TL;DR: 24-Acetylhydroshengmanol xyloside (CAS 78213-32-8) is a chemical compound with molecular formula C37H60O11 and molecular weight 680.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S)-1-[(4R,5R,6R,8S,10S,11R,12S,13R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]-2-hydroxy-2-methylpropyl] acetate
Also Known As: 24-Acetylhydroshengmanol xyloside, 24-O-Acetylhydroshengmanol xyloside, 9,19-Cyclolanostane-15,16,24,25-tetrol, 16,23-epoxy-3-(beta-D-xylopyranosyloxy)-, 24-acetate, (3beta,15alpha,16beta,23R,24S)-, 15,16,25-Trihydroxy-3-(pentopyranosyloxy)-16,23-epoxy-9,19-cyclolanostan-24-yl acetate, (5xi,9xi,23S,24S)-15alpha,16beta,25-Trihydroxy-3beta-(beta-D-xylopyranosyloxy)-17alpha-16,23-epoxy-9,19-cyclolanostan-24-yl acetate
| Molecular Formula | C37H60O11 |
|---|---|
| Molecular Weight | 680.41 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 680.4136 |
| Heavy Atoms | 48 |
| Complexity | 1310.0 |
Chemical Identifiers
| CAS Number | 78213-32-8 |
|---|---|
| SMILES | C[C@@H]1C[C@H](O[C@]2([C@H]1[C@]3(CCC45C[C@@]46CC[C@@H](C(C6CC[C@H]5[C@@]3([C@H]2O)C)(C)C)O[C@H]7[C@@H]([C@H]([C@@H](CO7)O)O)O)C)O)[C@@H](C(C)(C)O)OC(=O)C |
| InChIKey | PJGMIZSCETWMLA-HSBOZNPVSA-N |
Product Overview
24-Acetylhydroshengmanol xyloside (CAS 78213-32-8), with molecular formula C37H60O11 and molecular weight 680.41 g/mol. IUPAC: [(1S)-1-[(4R,5R,6R,8S,10S,11R,12S,13R,18S,21R)-10,11-dihydroxy-4,6,12,17,17-pentamethyl-18-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-9-oxahexacyclo[11.9.0.01,21.04,12.05,10.016,21]docosan-8-yl]-2-hydroxy-2-methylpropyl] acetate.
Chemical Property Profile of 24-Acetylhydroshengmanol xyloside
Property Insights of 24-Acetylhydroshengmanol xyloside
The XLogP value of 3.3 indicates that 24-Acetylhydroshengmanol xyloside is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 175.0 Ų indicates high polarity, suggesting 24-Acetylhydroshengmanol xyloside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 24-Acetylhydroshengmanol xyloside has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 24-Acetylhydroshengmanol xyloside?
The CAS number of 24-Acetylhydroshengmanol xyloside is 78213-32-8.
What is the molecular formula of 24-Acetylhydroshengmanol xyloside?
The molecular formula of 24-Acetylhydroshengmanol xyloside is C37H60O11.
What is the molecular weight of 24-Acetylhydroshengmanol xyloside?
The molecular weight of 24-Acetylhydroshengmanol xyloside is 680.41 g/mol.
Where can I buy 24-Acetylhydroshengmanol xyloside?
You can request a quote for 24-Acetylhydroshengmanol xyloside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 24-Acetylhydroshengmanol xyloside?
Yes, KEHONG BIO provides custom synthesis services for 24-Acetylhydroshengmanol xyloside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.