Astragaloside II
TL;DR: Astragaloside II (CAS 84676-89-1) is a chemical compound with molecular formula C43H70O15 and molecular weight 826.47 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3R,4S,5R)-4,5-dihydroxy-2-[(2R,3S,4R,5R,6R)-3,4,5-trihydroxy-2-[[(3R,9S,12S,14S,15R,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]-6-(hydroxymethyl)oxan-4-yl]oxyoxan-3-yl] acetate
Also Known As: Astragaloside II, [(2S,3R,4S,5R)-4,5-Dihydroxy-2-[(2R,3S,4R,5R,6R)-3,4,5-trihydroxy-2-[[(3R,9S,12S,14S,15R,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]-6-(hydroxymethyl)oxan-4-yl]oxyoxan-3-yl] acetate, (2S,3R,4S,5R)-4,5-dihydroxy-2-(((2R,3S,4R,5R,6R)-3,4,5-trihydroxy-2-(((2aR,3R,4S,5aS,7S,11aR)-4-hydroxy-3-((2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyltetrahydrofuran-2-yl)-2a,5a,8,8-tet, (2S,3R,4S,5R)-4,5-DIHYDROXY-2-{[(2R,3S,4R,5R,6R)-3,4,5-TRIHYDROXY-2-{[(3R,9S,12S,14S,15R,16R)-14-HYDROXY-15-[(2R,5S)-5-(2-HYDROXYPROPAN-2-YL)-2-METHYLOXOLAN-2-YL]-7,7,12,16-TETRAMETHYLPENTACYCLO[9.7.0.0(1),(3).0(3),?.0(1)(2),(1)?]OCTADECAN-9-YL]OXY}-6-(HYDROXYMETHYL)OXAN-4-YL]OXY}OXAN-3-YL ACETATE, beta-D-Glucopyranoside, (3beta,6alpha,16beta,20R,24S)-3-((2-O-acetyl-beta-D-xylopyranosyl)oxy)-20,24-epoxy-16,25-dihydroxy-9,19-cyclolanostan-6-yl
| Molecular Formula | C43H70O15 |
|---|---|
| Molecular Weight | 826.47 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 234.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 9 |
| Exact Mass | 826.4715 |
| Heavy Atoms | 58 |
| Complexity | 1590.0 |
Chemical Identifiers
| CAS Number | 84676-89-1 |
|---|---|
| SMILES | CC(=O)O[C@@H]1[C@H]([C@@H](CO[C@H]1O[C@@]2([C@@H]([C@H](O[C@H]([C@@H]2O)O[C@H]3CC4[C@@]5(C[C@@H]([C@@H]([C@]5(CCC46C[C@]67C3C(CCC7)(C)C)C)[C@]8(CC[C@H](O8)C(C)(C)O)C)O)C)CO)O)O)O)O |
| InChIKey | LFJNPJBIDAQEHH-BXPIHXSGSA-N |
Product Overview
Astragaloside II (CAS 84676-89-1), with molecular formula C43H70O15 and molecular weight 826.47 g/mol. IUPAC: [(2S,3R,4S,5R)-4,5-dihydroxy-2-[(2R,3S,4R,5R,6R)-3,4,5-trihydroxy-2-[[(3R,9S,12S,14S,15R,16R)-14-hydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-9-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]-6-(hydroxymethyl)oxan-4-yl]oxyoxan-3-yl] acetate.
Chemical Property Profile of Astragaloside II
Property Insights of Astragaloside II
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Astragaloside II. The TPSA of 234.0 Ų indicates high polarity, suggesting Astragaloside II may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Astragaloside II has 8 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Astragaloside II?
The CAS number of Astragaloside II is 84676-89-1.
What is the molecular formula of Astragaloside II?
The molecular formula of Astragaloside II is C43H70O15.
What is the molecular weight of Astragaloside II?
The molecular weight of Astragaloside II is 826.47 g/mol.
Where can I buy Astragaloside II?
You can request a quote for Astragaloside II directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Astragaloside II?
Yes, KEHONG BIO provides custom synthesis services for Astragaloside II and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.