Deutzicoside A
TL;DR: Deutzicoside A (CAS 137551-41-8) is a chemical compound with molecular formula C40H64O12 and molecular weight 736.43976 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4aR,5R,6aR,6aS,6bR,10S,12aR,14bR)-10-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-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: Deutzicoside A, Echinocystic acid-3-O-(arabinopyranosyl(1-4))-arabinopyranoside, (4aR,5R,6aR,6aS,6bR,10S,12aR,14bR)-10-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-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, 16-Hydroxy-3-[(4-O-pentopyranosylpentopyranosyl)oxy]olean-12-en-28-oic acid, (5xi)-3beta-[(4-O-alpha-L-Arabinopyranosyl-alpha-L-arabinopyranosyl)oxy]-16alpha-hydroxy-18alpha-olean-12-en-28-oic acid
Technical Specifications
| Molecular Formula | C40H64O12 |
| Molecular Weight | 736.43976 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 196.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 736.43976 Da |
| Heavy Atoms | 52 |
| Complexity | 1420.0 |
| SMILES | C[C@]12CC[C@@H](C(C1CC[C@@]3([C@@H]2CC=C4[C@]3(C[C@H]([C@@]5([C@@H]4CC(CC5)(C)C)C(=O)O)O)C)C)(C)C)O[C@H]6[C@@H]([C@H]([C@H](CO6)O[C@H]7[C@@H]([C@H]([C@H](CO7)O)O)O)O)O |
| InChIKey | DFBQUTBOVLBEHN-OOLIYSFKSA-N |
Chemical Property Profile of Deutzicoside A
Property Insights of Deutzicoside A
The XLogP value of 3.8 indicates that Deutzicoside A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 196.0 Ų indicates high polarity, suggesting Deutzicoside A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Deutzicoside A has 7 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Deutzicoside A?
The CAS number of Deutzicoside A is 137551-41-8.
What is the molecular formula of Deutzicoside A?
The molecular formula of Deutzicoside A is C40H64O12.
What is the molecular weight of Deutzicoside A?
The molecular weight of Deutzicoside A is 736.43976 g/mol.
Where can I buy Deutzicoside A?
You can request a quote for Deutzicoside A directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Deutzicoside A?
Yes, CoreyChem provides custom synthesis services for Deutzicoside A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.