Olaxoside
TL;DR: Olaxoside (CAS 80135-33-7) is a chemical compound with molecular formula C48H76O18 and molecular weight 940.50 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4R,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4,4,6a,6b,11,11,14b-heptamethyl-8a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxane-2-carboxylic acid
Also Known As: Olaxoside, (2S,3S,4R,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4,4,6a,6b,11,11,14b-heptamethyl-8a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxane-2-carboxylic acid, (2S,3S,4R,5R,6R)-6-{[(3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4,4,6a,6b,11,11,14b-heptamethyl-8a-({[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}carbonyl)-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl]oxy}-4,5-dihydroxy-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxane-2-carboxylic acid, 1-O-(3beta-{[4-O-(6-Deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranuronosyl]oxy}-28-oxoolean-12-en-28-yl)-beta-D-glucopyranose, 28-(beta-D-Glucopyranosyloxy)-28-oxooleana-12-ene-3beta-yl 4-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranosiduronic acid
| Molecular Formula | C48H76O18 |
|---|---|
| Molecular Weight | 940.50 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 292.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 9 |
| Exact Mass | 940.5032 |
| Heavy Atoms | 66 |
| Complexity | 1860.0 |
Chemical Identifiers
| CAS Number | 80135-33-7 |
|---|---|
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2[C@@H]([C@H]([C@@H](O[C@@H]2C(=O)O)O[C@H]3CC[C@]4([C@H](C3(C)C)CC[C@@]5([C@@H]4CC=C6[C@]5(CC[C@@]7([C@H]6CC(CC7)(C)C)C(=O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)C)C)C)O)O)O)O)O |
| InChIKey | FWGUQBCYEUGRPQ-IRWWUQPRSA-N |
Product Overview
Olaxoside (CAS 80135-33-7), with molecular formula C48H76O18 and molecular weight 940.50 g/mol. IUPAC: (2S,3S,4R,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4,4,6a,6b,11,11,14b-heptamethyl-8a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxane-2-carboxylic acid.
Chemical Property Profile of Olaxoside
Property Insights of Olaxoside
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Olaxoside. The TPSA of 292.0 Ų indicates high polarity, suggesting Olaxoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Olaxoside has 10 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Olaxoside?
The CAS number of Olaxoside is 80135-33-7.
What is the molecular formula of Olaxoside?
The molecular formula of Olaxoside is C48H76O18.
What is the molecular weight of Olaxoside?
The molecular weight of Olaxoside is 940.50 g/mol.
Where can I buy Olaxoside?
You can request a quote for Olaxoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Olaxoside?
Yes, KEHONG BIO provides custom synthesis services for Olaxoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.