梓糖苷
TL;DR: 梓糖苷 (CAS 6736-85-2) is a chemical compound with molecular formula C22H26O12 and molecular weight 482.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
梓糖苷
[(1S,2S,4S,5S,6R,10S)-2-(hydroxymethyl)-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl] 4-hydroxybenzoate
Also Known As: Catalposide, Catalpin, Hydroxybenzoyl catalpol, CATALPOSIDE [MI], (HYDROXYBENZOYL)CATALPOL
| Molecular Formula | C22H26O12 |
|---|---|
| Molecular Weight | 482.14 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 188.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 7 |
| Exact Mass | 482.14243 |
| Heavy Atoms | 34 |
| Complexity | 784.0 |
Chemical Identifiers
| CAS Number | 6736-85-2 |
|---|---|
| SMILES | C1=CO[C@H]([C@H]2[C@@H]1[C@@H]([C@H]3[C@@]2(O3)CO)OC(=O)C4=CC=C(C=C4)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O |
| InChIKey | UXSACQOOWZMGSE-RWORTQBESA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
梓糖苷 (CAS 6736-85-2), with molecular formula C22H26O12 and molecular weight 482.14 g/mol. IUPAC: [(1S,2S,4S,5S,6R,10S)-2-(hydroxymethyl)-10-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl] 4-hydroxybenzoate.
Chemical Property Profile of 梓糖苷
Property Insights of 梓糖苷
The XLogP value of -1.3 indicates that 梓糖苷 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 188.0 Ų indicates high polarity, suggesting 梓糖苷 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 梓糖苷 has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 梓糖苷?
The CAS number of 梓糖苷 is 6736-85-2.
What is the molecular formula of 梓糖苷?
The molecular formula of 梓糖苷 is C22H26O12.
What is the molecular weight of 梓糖苷?
The molecular weight of 梓糖苷 is 482.14 g/mol.
Where can I buy 梓糖苷?
You can request a quote for 梓糖苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 梓糖苷?
Yes, KEHONG BIO provides custom synthesis services for 梓糖苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.