Acutotrinol
TL;DR: Acutotrinol (CAS 145940-30-3) is a chemical compound with molecular formula C17H18O7 and molecular weight 334.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(7E)-6-hydroxy-3,8-dimethyl-4,13-dioxo-5,14-dioxatricyclo[10.2.1.02,6]pentadeca-2,7,12(15)-trien-9-yl] acetate
Also Known As: Acutotrinol, 6H-4,7-Methenofuro(3,2-c)oxacycloundecin-2,6(4H)-dione, 10-(acetyloxy)-8,9,10,12a-tetrahydro-12a-hydroxy-3,11-dimethyl-, (4R,10R,11Z,12aS)-
| Molecular Formula | C17H18O7 |
|---|---|
| Molecular Weight | 334.11 g/mol |
| LogP | 1.0719 |
| Topological Polar Surface Area | 99.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 334.10526 |
| Heavy Atoms | 24 |
| Complexity | 727.22107 |
Chemical Identifiers
| CAS Number | 145940-30-3 |
|---|---|
| SMILES | C/C/1=C\C2(C(=C(C(=O)O2)C)C3C=C(CCC1OC(=O)C)C(=O)O3)O |
Product Overview
Acutotrinol (CAS 145940-30-3), with molecular formula C17H18O7 and molecular weight 334.11 g/mol. IUPAC: [(7E)-6-hydroxy-3,8-dimethyl-4,13-dioxo-5,14-dioxatricyclo[10.2.1.02,6]pentadeca-2,7,12(15)-trien-9-yl] acetate.
Chemical Property Profile of Acutotrinol
Property Insights of Acutotrinol
The XLogP value of 1.0719 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acutotrinol. The TPSA of 99.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Acutotrinol. Following Lipinski's Rule of Five, Acutotrinol has 1 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 Acutotrinol?
The CAS number of Acutotrinol is 145940-30-3.
What is the molecular formula of Acutotrinol?
The molecular formula of Acutotrinol is C17H18O7.
What is the molecular weight of Acutotrinol?
The molecular weight of Acutotrinol is 334.11 g/mol.
Where can I buy Acutotrinol?
You can request a quote for Acutotrinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acutotrinol?
Yes, KEHONG BIO provides custom synthesis services for Acutotrinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.