Wentilactone B
TL;DR: Wentilactone B (CAS 76236-26-5) is a chemical compound with molecular formula C16H18O5 and molecular weight 290.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,9R,12S,14R,16R)-14-hydroxy-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-2,7-diene-4,11-dione
Also Known As: Wentilactone B, (1S,9R,12S,14R,16R)-14-hydroxy-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-2,7-diene-4,11-dione, (1S,9R,12S,14S,16R)-14-hydroxy-1,12-dimethyl-5,10-dioxatetracyclo(7.6.1.02,7.012,16)hexadeca-2,7-diene-4,11-dione, (2R,3aS,5aR,10bS,10cR)-2-Hydroxy-3a,10b-dimethyl-1,2,3,3a,5a,7,10b,10c-octahydro-4H,9H-furo[2',3',4':4,5]naphtho[2,1-c]pyran-4,9-dione, 2-hydroxy-3a,10b-dimethyl-1,2,3,3a,3a1,5a,7,10b-octahydro-4H,9H-isobenzofuro[7,1-fg]isochromene-4,9-dione
| Molecular Formula | C16H18O5 |
|---|---|
| Molecular Weight | 290.12 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 290.11542 |
| Heavy Atoms | 21 |
| Complexity | 618.0 |
Chemical Identifiers
| CAS Number | 76236-26-5 |
|---|---|
| SMILES | C[C@]12C[C@H](C[C@]3([C@@H]1[C@@H](C=C4C2=CC(=O)OC4)OC3=O)C)O |
| InChIKey | NQUNKSRIHYKOIX-QFLIJWGCSA-N |
Product Overview
Wentilactone B (CAS 76236-26-5), with molecular formula C16H18O5 and molecular weight 290.12 g/mol. IUPAC: (1S,9R,12S,14R,16R)-14-hydroxy-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.02,7.012,16]hexadeca-2,7-diene-4,11-dione.
Chemical Property Profile of Wentilactone B
Property Insights of Wentilactone B
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Wentilactone B. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Wentilactone B. Following Lipinski's Rule of Five, Wentilactone 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 Wentilactone B?
The CAS number of Wentilactone B is 76236-26-5.
What is the molecular formula of Wentilactone B?
The molecular formula of Wentilactone B is C16H18O5.
What is the molecular weight of Wentilactone B?
The molecular weight of Wentilactone B is 290.12 g/mol.
Where can I buy Wentilactone B?
You can request a quote for Wentilactone B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Wentilactone B?
Yes, KEHONG BIO provides custom synthesis services for Wentilactone B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.