Cinnamosmolide B812927K029
TL;DR: Cinnamosmolide B812927K029 (CAS 23599-46-4) is a chemical compound with molecular formula C17H24O5 and molecular weight 308.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9b-hydroxy-6,6,9a-trimethyl-3-oxo-1,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-5-yl) acetate
Also Known As: CINNAMOSMOLIDE B812927K029, 9b-hydroxy-6,6,9a-trimethyl-3-oxo-1,3,5,5a,6,7,8,9,9a,9b-decahydronaphtho[1,2-c]furan-5-yl acetate, (9b-hydroxy-6,6,9a-trimethyl-3-oxo-1,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-5-yl) acetate, Naphtho[1,2-c]furan-3(1H)-one, 5-(acetyloxy)-5,5a,6,7,8,9,9a,9b-octahydro-9b-hydroxy-6,6,9a-trimethyl-, (5R,5aS,9aS,9bS)-
| Molecular Formula | C17H24O5 |
|---|---|
| Molecular Weight | 308.16 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 308.16238 |
| Heavy Atoms | 22 |
| Complexity | 563.0 |
Chemical Identifiers
| CAS Number | 23599-46-4 |
|---|---|
| SMILES | CC(=O)OC1C=C2C(=O)OCC2(C3(C1C(CCC3)(C)C)C)O |
| InChIKey | PSJFPRLDKNCZGQ-UHFFFAOYSA-N |
Product Overview
Cinnamosmolide B812927K029 (CAS 23599-46-4), with molecular formula C17H24O5 and molecular weight 308.16 g/mol. IUPAC: (9b-hydroxy-6,6,9a-trimethyl-3-oxo-1,5,5a,7,8,9-hexahydrobenzo[e][2]benzofuran-5-yl) acetate.
Chemical Property Profile of Cinnamosmolide B812927K029
Property Insights of Cinnamosmolide B812927K029
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cinnamosmolide B812927K029. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Cinnamosmolide B812927K029. Following Lipinski's Rule of Five, Cinnamosmolide B812927K029 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 Cinnamosmolide B812927K029?
The CAS number of Cinnamosmolide B812927K029 is 23599-46-4.
What is the molecular formula of Cinnamosmolide B812927K029?
The molecular formula of Cinnamosmolide B812927K029 is C17H24O5.
What is the molecular weight of Cinnamosmolide B812927K029?
The molecular weight of Cinnamosmolide B812927K029 is 308.16 g/mol.
Where can I buy Cinnamosmolide B812927K029?
You can request a quote for Cinnamosmolide B812927K029 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinnamosmolide B812927K029?
Yes, KEHONG BIO provides custom synthesis services for Cinnamosmolide B812927K029 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.