Talaromycin B
TL;DR: Talaromycin B (CAS 83780-27-2) is a chemical compound with molecular formula C12H22O4 and molecular weight 230.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,4S,6R,9R)-9-ethyl-3-(hydroxymethyl)-1,7-dioxaspiro[5.5]undecan-4-ol
Also Known As: Talaromycin B, (-)-Talaromycin B, TALAROMYCIN-B, 1,2-Dioctanoylthiophosphatidylcholine, (3S,4S,6R,9R)-9-ETHYL-3-(HYDROXYMETHYL)-1,7-DIOXASPIRO[5.5]UNDECAN-4-OL
| Molecular Formula | C12H22O4 |
|---|---|
| Molecular Weight | 230.15 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.15181 |
| Heavy Atoms | 16 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 83780-27-2 |
|---|---|
| SMILES | CC[C@@H]1CC[C@@]2(C[C@@H]([C@H](CO2)CO)O)OC1 |
| InChIKey | VDWRKBZMQNPUOB-NOOOWODRSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Talaromycin B (CAS 83780-27-2), with molecular formula C12H22O4 and molecular weight 230.15 g/mol. IUPAC: (3S,4S,6R,9R)-9-ethyl-3-(hydroxymethyl)-1,7-dioxaspiro[5.5]undecan-4-ol.
Chemical Property Profile of Talaromycin B
Property Insights of Talaromycin B
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Talaromycin B. With a topological polar surface area (TPSA) of 58.9 Ų, Talaromycin B exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Talaromycin B has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Talaromycin B?
The CAS number of Talaromycin B is 83780-27-2.
What is the molecular formula of Talaromycin B?
The molecular formula of Talaromycin B is C12H22O4.
What is the molecular weight of Talaromycin B?
The molecular weight of Talaromycin B is 230.15 g/mol.
Where can I buy Talaromycin B?
You can request a quote for Talaromycin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Talaromycin B?
Yes, KEHONG BIO provides custom synthesis services for Talaromycin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.