Speciformin
TL;DR: Speciformin (CAS 41653-77-4) is a chemical compound with molecular formula C15H20O4 and molecular weight 264.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8E)-2-hydroxy-5,9-dimethyl-14-methylidene-4,12-dioxatricyclo[9.3.0.03,5]tetradec-8-en-13-one
Also Known As: Speciformin, Spiciformin, Oxireno(4,5)cyclodeca(1,2-b)furan-8(1aH)-one, 2,3,6,6a,9,9a,10,10a-octahydro-10-hydroxy-1a,5-dimethyl-9-methylene-, (1aS-(1aR*,4E,6aR*,9aR*,10R*,10aS*))-
| Molecular Formula | C15H20O4 |
|---|---|
| Molecular Weight | 264.14 g/mol |
| LogP | 1.7328 |
| Topological Polar Surface Area | 59.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 264.13617 |
| Heavy Atoms | 19 |
| Complexity | 466.76602 |
Chemical Identifiers
| CAS Number | 41653-77-4 |
|---|---|
| SMILES | C/C/1=C\CCC2(C(O2)C(C3C(C1)OC(=O)C3=C)O)C |
Product Overview
Speciformin (CAS 41653-77-4), with molecular formula C15H20O4 and molecular weight 264.14 g/mol. IUPAC: (8E)-2-hydroxy-5,9-dimethyl-14-methylidene-4,12-dioxatricyclo[9.3.0.03,5]tetradec-8-en-13-one.
Chemical Property Profile of Speciformin
Property Insights of Speciformin
The XLogP value of 1.7328 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Speciformin. With a topological polar surface area (TPSA) of 59.06 Ų, Speciformin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Speciformin has 1 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 Speciformin?
The CAS number of Speciformin is 41653-77-4.
What is the molecular formula of Speciformin?
The molecular formula of Speciformin is C15H20O4.
What is the molecular weight of Speciformin?
The molecular weight of Speciformin is 264.14 g/mol.
Where can I buy Speciformin?
You can request a quote for Speciformin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Speciformin?
Yes, KEHONG BIO provides custom synthesis services for Speciformin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.