Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)-
TL;DR: Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)- (CAS 30248-05-6) is a chemical compound with molecular formula C22H34O7 and molecular weight 410.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11,14,16-trihydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-3-one
Also Known As: NIGAKIHEMIACETAL A, 11,13,16-Trihydroxy-2,12-dimethoxypicras-2-en-1-one, 11,13,16-Trihydroxy-2,12-dimethoxypicras-2-en-1-one #, Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11.alpha.,12.beta.)-, Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)-
| Molecular Formula | C22H34O7 |
|---|---|
| Molecular Weight | 410.23 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 410.23044 |
| Heavy Atoms | 29 |
| Complexity | 737.0 |
Chemical Identifiers
| CAS Number | 30248-05-6 |
|---|---|
| SMILES | CC1C=C(C(=O)C2(C1CC3C4(C2C(C(C(C4CC(O3)O)(C)O)OC)O)C)C)OC |
| InChIKey | POGHHDUAPIJTLG-UHFFFAOYSA-N |
Product Overview
Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)- (CAS 30248-05-6), with molecular formula C22H34O7 and molecular weight 410.23 g/mol. IUPAC: 11,14,16-trihydroxy-4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-4-en-3-one.
Chemical Property Profile of Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)-
Property Insights of Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)-. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)-. Following Lipinski's Rule of Five, Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)- has 3 hydrogen bond donor(s) and 7 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 Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)-?
The CAS number of Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)- is 30248-05-6.
What is the molecular formula of Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)-?
The molecular formula of Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)- is C22H34O7.
What is the molecular weight of Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)-?
The molecular weight of Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)- is 410.23 g/mol.
Where can I buy Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)-?
You can request a quote for Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)-?
Yes, KEHONG BIO provides custom synthesis services for Picras-2-en-1-one, 11,13,16-trihydroxy-2,12-dimethoxy-, (11alpha,12beta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.