三半乳糖醛酸
TL;DR: 三半乳糖醛酸 (CAS 6037-45-2) is a chemical compound with molecular formula C18H26O19 and molecular weight 546.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
三半乳糖醛酸
(2S,3R,4S,5R,6S)-6-[(2S,3R,4R,5R,6S)-2-carboxy-6-[(1S,2R,3R,4R)-1-carboxy-1,3,4-trihydroxy-5-oxopentan-2-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: Trigalacturonic acid, GalA-GalA-GalA, alpha-Gala-gala-gala, TRIGALACTURONICACID, Gala-(1-4)-gala-(1-4)-gala
| Molecular Formula | C18H26O19 |
|---|---|
| Molecular Weight | 546.11 g/mol |
| LogP | -7.4535 |
| Topological Polar Surface Area | 327.73 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 11 |
| Exact Mass | 546.1068 |
| Heavy Atoms | 37 |
| Complexity | 835.8364 |
Chemical Identifiers
| CAS Number | 6037-45-2 |
|---|---|
| SMILES | C(=O)[C@@H]([C@H]([C@H]([C@@H](C(=O)O)O)O[C@@H]1[C@@H]([C@H]([C@H]([C@H](O1)C(=O)O)O[C@@H]2[C@@H]([C@H]([C@H]([C@H](O2)C(=O)O)O)O)O)O)O)O)O |
Product Overview
三半乳糖醛酸 (CAS 6037-45-2), with molecular formula C18H26O19 and molecular weight 546.11 g/mol. IUPAC: (2S,3R,4S,5R,6S)-6-[(2S,3R,4R,5R,6S)-2-carboxy-6-[(1S,2R,3R,4R)-1-carboxy-1,3,4-trihydroxy-5-oxopentan-2-yl]oxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of 三半乳糖醛酸
Property Insights of 三半乳糖醛酸
The XLogP value of -7.4535 indicates that 三半乳糖醛酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 327.73 Ų indicates high polarity, suggesting 三半乳糖醛酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 三半乳糖醛酸 has 11 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 三半乳糖醛酸?
The CAS number of 三半乳糖醛酸 is 6037-45-2.
What is the molecular formula of 三半乳糖醛酸?
The molecular formula of 三半乳糖醛酸 is C18H26O19.
What is the molecular weight of 三半乳糖醛酸?
The molecular weight of 三半乳糖醛酸 is 546.11 g/mol.
Where can I buy 三半乳糖醛酸?
You can request a quote for 三半乳糖醛酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 三半乳糖醛酸?
Yes, KEHONG BIO provides custom synthesis services for 三半乳糖醛酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.