Hupehemonoside
TL;DR: Hupehemonoside (CAS 32685-93-1) is a chemical compound with molecular formula C33H53NO8 and molecular weight 591.38 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2S,6S,9S,10S,11R,14S,15S,18S,20S,23R,24S)-10-hydroxy-6,10,23-trimethyl-20-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosan-17-one
Also Known As: Hupehemonoside, Imperialine 3-beta-D-glucoside, Zhebeinonoside, Glucoimperialine, Edpetiline
| Molecular Formula | C33H53NO8 |
|---|---|
| Molecular Weight | 591.38 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 591.37714 |
| Heavy Atoms | 42 |
| Complexity | 1040.0 |
Chemical Identifiers
| CAS Number | 32685-93-1 |
|---|---|
| SMILES | C[C@H]1CC[C@H]2[C@@]([C@@H]3CC[C@@H]4[C@H]([C@@H]3CN2C1)C[C@H]5[C@H]4CC(=O)[C@@H]6[C@@]5(CC[C@@H](C6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)C)(C)O |
| InChIKey | DHQFYEJMFMYGCV-DLJWJMOOSA-N |
Product Overview
Hupehemonoside (CAS 32685-93-1), with molecular formula C33H53NO8 and molecular weight 591.38 g/mol. IUPAC: (1R,2S,6S,9S,10S,11R,14S,15S,18S,20S,23R,24S)-10-hydroxy-6,10,23-trimethyl-20-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4-azahexacyclo[12.11.0.02,11.04,9.015,24.018,23]pentacosan-17-one.
Chemical Property Profile of Hupehemonoside
Property Insights of Hupehemonoside
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hupehemonoside. The TPSA of 140.0 Ų indicates high polarity, suggesting Hupehemonoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hupehemonoside has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hupehemonoside?
The CAS number of Hupehemonoside is 32685-93-1.
What is the molecular formula of Hupehemonoside?
The molecular formula of Hupehemonoside is C33H53NO8.
What is the molecular weight of Hupehemonoside?
The molecular weight of Hupehemonoside is 591.38 g/mol.
Where can I buy Hupehemonoside?
You can request a quote for Hupehemonoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hupehemonoside?
Yes, KEHONG BIO provides custom synthesis services for Hupehemonoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.