3'-Deoxytalopiericidin A1
TL;DR: 3'-Deoxytalopiericidin A1 (CAS 134876-72-5) is a chemical compound with molecular formula C31H47NO8 and molecular weight 561.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6R)-2-[[2-[(2Z,5Z,7Z,9R,10R,11Z)-10-hydroxy-3,7,9,11-tetramethyltrideca-2,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-4-pyridinyl]oxy]-6-methyloxane-3,4,5-triol
Also Known As: 3'-Deoxytalopiericidin A1, 3-Dtp-A1, 3'-Deoxytalopiericidin, 3/'-Deoxytalopiericidin A1, (2S,3S,4S,5R,6R)-2-[2-[(2Z,5Z,7Z,9R,10R,11Z)-10-hydroxy-3,7,9,11-tetramethyltrideca-2,5,7,11-tetraenyl]-5,6-dimethoxy-3-methylpyridin-4-yl]oxy-6-methyloxane-3,4,5-triol
| Molecular Formula | C31H47NO8 |
|---|---|
| Molecular Weight | 561.33 g/mol |
| LogP | 3.95812 |
| Topological Polar Surface Area | 130.73 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 561.33014 |
| Heavy Atoms | 40 |
| Complexity | 1109.0428 |
Chemical Identifiers
| CAS Number | 134876-72-5 |
|---|---|
| SMILES | C/C=C(/C)\[C@@H]([C@H](C)/C=C(/C)\C=C/C/C(=C\CC1=C(C(=C(C(=N1)OC)OC)O[C@H]2[C@H]([C@H]([C@H]([C@H](O2)C)O)O)O)C)/C)O |
Product Overview
3'-Deoxytalopiericidin A1 (CAS 134876-72-5), with molecular formula C31H47NO8 and molecular weight 561.33 g/mol. IUPAC: (2S,3S,4S,5R,6R)-2-[[2-[(2Z,5Z,7Z,9R,10R,11Z)-10-hydroxy-3,7,9,11-tetramethyltrideca-2,5,7,11-tetraenyl]-5,6-dimethoxy-3-methyl-4-pyridinyl]oxy]-6-methyloxane-3,4,5-triol.
Chemical Property Profile of 3'-Deoxytalopiericidin A1
Property Insights of 3'-Deoxytalopiericidin A1
The XLogP value of 3.95812 indicates that 3'-Deoxytalopiericidin A1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 130.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-Deoxytalopiericidin A1. Following Lipinski's Rule of Five, 3'-Deoxytalopiericidin A1 has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3'-Deoxytalopiericidin A1?
The CAS number of 3'-Deoxytalopiericidin A1 is 134876-72-5.
What is the molecular formula of 3'-Deoxytalopiericidin A1?
The molecular formula of 3'-Deoxytalopiericidin A1 is C31H47NO8.
What is the molecular weight of 3'-Deoxytalopiericidin A1?
The molecular weight of 3'-Deoxytalopiericidin A1 is 561.33 g/mol.
Where can I buy 3'-Deoxytalopiericidin A1?
You can request a quote for 3'-Deoxytalopiericidin A1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Deoxytalopiericidin A1?
Yes, KEHONG BIO provides custom synthesis services for 3'-Deoxytalopiericidin A1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.