Cordatolide B
TL;DR: Cordatolide B (CAS 98524-45-9) is a chemical compound with molecular formula C20H22O5 and molecular weight 342.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(16R,17S,18R)-18-hydroxy-6,10,10,16,17-pentamethyl-3,9,15-trioxatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),5,8(13),11-pentaen-4-one
Also Known As: Cordatolide B, Cordatolide A, hydroxy(pentamethyl)[?]one, (16R,17S,18R)-18-hydroxy-6,10,10,16,17-pentamethyl-3,9,15-trioxatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),5,8(13),11-pentaen-4-one, 2H,6H,10H-Benzo(1,2-b:3,4-b':5,6-b'')tripyan-2-one, 11,12-dihydro-12-hydroxy-4,6,6,10,11-pentamethyl-, (10alpha,11beta,12beta)-(-)-
| Molecular Formula | C20H22O5 |
|---|---|
| Molecular Weight | 342.15 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 342.14673 |
| Heavy Atoms | 25 |
| Complexity | 636.0 |
Chemical Identifiers
| CAS Number | 98524-45-9 |
|---|---|
| SMILES | C[C@@H]1[C@H](OC2=C([C@@H]1O)C3=C(C(=CC(=O)O3)C)C4=C2C=CC(O4)(C)C)C |
| InChIKey | VFKOXOKVQKGOTG-GLKRBJQHSA-N |
Product Overview
Cordatolide B (CAS 98524-45-9), with molecular formula C20H22O5 and molecular weight 342.15 g/mol. IUPAC: (16R,17S,18R)-18-hydroxy-6,10,10,16,17-pentamethyl-3,9,15-trioxatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),5,8(13),11-pentaen-4-one.
Chemical Property Profile of Cordatolide B
Property Insights of Cordatolide B
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cordatolide B. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Cordatolide B. Following Lipinski's Rule of Five, Cordatolide B has 1 hydrogen bond donor(s) and 5 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 Cordatolide B?
The CAS number of Cordatolide B is 98524-45-9.
What is the molecular formula of Cordatolide B?
The molecular formula of Cordatolide B is C20H22O5.
What is the molecular weight of Cordatolide B?
The molecular weight of Cordatolide B is 342.15 g/mol.
Where can I buy Cordatolide B?
You can request a quote for Cordatolide B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cordatolide B?
Yes, KEHONG BIO provides custom synthesis services for Cordatolide B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.