Ardipusilloside II
TL;DR: Ardipusilloside II (CAS 153127-35-6) is a chemical compound with molecular formula C58H94O27 and molecular weight 1222.60 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,4S,5R,10S,13R,14R,18S,20R)-10-[(2S,3R,4S,5S)-3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-4,5-bis[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-2-hydroxy-4,5,9,9,13,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosane-20-carbaldehyde
Also Known As: Ardipusilloside II, 3-O-(Xylopyranosyl-1-2-glucopyranosyl-1-4)(glucopyranosyl-1-2-glucopyranosyl-1-2)-rhamnopyranosylcyclamiretin A, Oleanan-29-al, 13,28-epoxy-3-((O-beta-D-glucopyranosyl-(1-2)-O-beta-D-glucopyranosyl-(1-2)-O-(O-beta-D-xylopyranosyl-(1-2)-beta-D-glucopyranosyl-(1-4))-alpha-L-arabinopyranosyl)oxy)-16-hydroxy-, (3beta,16alpha,20beta)-, (2R,4S,5R,10S,13R,14R,18S,20R)-10-[(2S,3R,4S,5S)-3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-4,5-bis[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-2-hydroxy-4,5,9,9,13,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosane-20-carbaldehyde
| Molecular Formula | C58H94O27 |
|---|---|
| Molecular Weight | 1222.60 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 422.0 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 27 |
| Rotatable Bonds | 14 |
| Exact Mass | 1222.5983 |
| Heavy Atoms | 85 |
| Complexity | 2340.0 |
Chemical Identifiers
| CAS Number | 153127-35-6 |
|---|---|
| SMILES | C[C@]1(CCC23COC4([C@H]2C1)CC[C@@H]5[C@]6(CC[C@@H](C(C6CC[C@]5([C@@]4(C[C@H]3O)C)C)(C)C)O[C@H]7[C@@H]([C@H]([C@H](CO7)O[C@@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)O[C@@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@H]1[C@@H]([C@H]([C@@H](CO1)O)O)O)C)C=O |
| InChIKey | OPEWQJDJWKXIPC-OSHGGGOQSA-N |
Product Overview
Ardipusilloside II (CAS 153127-35-6), with molecular formula C58H94O27 and molecular weight 1222.60 g/mol. IUPAC: (2R,4S,5R,10S,13R,14R,18S,20R)-10-[(2S,3R,4S,5S)-3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-4,5-bis[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]oxan-2-yl]oxy-2-hydroxy-4,5,9,9,13,20-hexamethyl-24-oxahexacyclo[15.5.2.01,18.04,17.05,14.08,13]tetracosane-20-carbaldehyde.
Chemical Property Profile of Ardipusilloside II
Property Insights of Ardipusilloside II
The XLogP value of -2.7 indicates that Ardipusilloside II is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 422.0 Ų indicates high polarity, suggesting Ardipusilloside II may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ardipusilloside II has 15 hydrogen bond donor(s) and 27 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ardipusilloside II?
The CAS number of Ardipusilloside II is 153127-35-6.
What is the molecular formula of Ardipusilloside II?
The molecular formula of Ardipusilloside II is C58H94O27.
What is the molecular weight of Ardipusilloside II?
The molecular weight of Ardipusilloside II is 1222.60 g/mol.
Where can I buy Ardipusilloside II?
You can request a quote for Ardipusilloside II directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ardipusilloside II?
Yes, KEHONG BIO provides custom synthesis services for Ardipusilloside II and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.