Aridanin
TL;DR: Aridanin (CAS 81053-26-1) is a chemical compound with molecular formula C38H61NO8 and molecular weight 659.44 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Also Known As: Aridanin, KST-1A8590, (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid, (3, A)-3-{[2-(acetylamino)-2-deoxy-
| Molecular Formula | C38H61NO8 |
|---|---|
| Molecular Weight | 659.44 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 659.4397 |
| Heavy Atoms | 47 |
| Complexity | 1300.0 |
Chemical Identifiers
| CAS Number | 81053-26-1 |
|---|---|
| SMILES | CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@H]2CC[C@]3([C@H](C2(C)C)CC[C@@]4([C@@H]3CC=C5[C@]4(CC[C@@]6([C@H]5CC(CC6)(C)C)C(=O)O)C)C)C)CO)O)O |
| InChIKey | VRFWJSCLROXBBW-FUHHSGJXSA-N |
Product Overview
Aridanin (CAS 81053-26-1), with molecular formula C38H61NO8 and molecular weight 659.44 g/mol. IUPAC: (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-[(2R,3R,4R,5S,6R)-3-acetamido-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid.
Chemical Property Profile of Aridanin
Property Insights of Aridanin
The XLogP value of 5.9 indicates that Aridanin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.0 Ų indicates high polarity, suggesting Aridanin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Aridanin has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Aridanin?
The CAS number of Aridanin is 81053-26-1.
What is the molecular formula of Aridanin?
The molecular formula of Aridanin is C38H61NO8.
What is the molecular weight of Aridanin?
The molecular weight of Aridanin is 659.44 g/mol.
Where can I buy Aridanin?
You can request a quote for Aridanin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aridanin?
Yes, KEHONG BIO provides custom synthesis services for Aridanin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.