茜根酸
TL;DR: 茜根酸 (CAS 152-84-1) is a chemical compound with molecular formula C25H26O13 and molecular weight 534.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
茜根酸
1-hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyanthracene-9,10-dione
Also Known As: Ruberythric acid, Rubianic acid, Rubierythric acid, Alizarin primeveroside, Ruberythnic acid
| Molecular Formula | C25H26O13 |
|---|---|
| Molecular Weight | 534.14 g/mol |
| LogP | -1.2 |
| Topological Polar Surface Area | 213.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 5 |
| Exact Mass | 534.1373 |
| Heavy Atoms | 38 |
| Complexity | 870.0 |
Chemical Identifiers
| CAS Number | 152-84-1 |
|---|---|
| SMILES | C1[C@H]([C@@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=C(C4=C(C=C3)C(=O)C5=CC=CC=C5C4=O)O)O)O)O)O)O)O |
| InChIKey | GCGGSVAWTYHZBI-CVQRFVFPSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
茜根酸 (CAS 152-84-1), with molecular formula C25H26O13 and molecular weight 534.14 g/mol. IUPAC: 1-hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyanthracene-9,10-dione.
Chemical Property Profile of 茜根酸
Property Insights of 茜根酸
The XLogP value of -1.2 indicates that 茜根酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 213.0 Ų indicates high polarity, suggesting 茜根酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 茜根酸 has 7 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 茜根酸?
The CAS number of 茜根酸 is 152-84-1.
What is the molecular formula of 茜根酸?
The molecular formula of 茜根酸 is C25H26O13.
What is the molecular weight of 茜根酸?
The molecular weight of 茜根酸 is 534.14 g/mol.
Where can I buy 茜根酸?
You can request a quote for 茜根酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 茜根酸?
Yes, KEHONG BIO provides custom synthesis services for 茜根酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.