Eremofortin A
TL;DR: Eremofortin A (CAS 62445-06-1) is a chemical compound with molecular formula C17H22O5 and molecular weight 306.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1aR,2R,3R,3aR,7bS)-3,3',3',3a-tetramethyl-6-oxospiro[2,3,4,7b-tetrahydro-1aH-naphtho[1,2-b]oxirene-5,2'-oxirane]-2-yl] acetate
Also Known As: Eremofortin A, [(1aR,2R,3R,3aR,7bS)-3,3',3',3a-tetramethyl-6-oxospiro[2,3,4,7b-tetrahydro-1aH-naphtho[1,2-b]oxirene-5,2'-oxirane]-2-yl] acetate, (1aR,5R)-2alpha-Acetoxy-1abeta,2,3,3a,4,7bbeta-hexahydro-3alpha,3',3',3aalpha-tetramethylspiro[naphth[1,2-b]oxirene-5(6H),2'-oxiran]-6-one, (1aR,2R,3R,3aR,7bS)-3,3',3',3a-Tetramethyl-6-oxo-2,3,3a,4,6,7b-hexahydro-1aH-spiro[naphtho[1,2-b]oxirene-5,2'-oxiran]-2-yl acetate, [(1aR,2R,3R,3aR,7bS)-3,3',3',3a-tetramethyl-6-oxo-spiro[2,3,4,7b-tetrahydro-1aH-naphtho[1,2-b]oxirene-5,2'-oxirane]-2-yl] acetate
| Molecular Formula | C17H22O5 |
|---|---|
| Molecular Weight | 306.15 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 68.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.14673 |
| Heavy Atoms | 22 |
| Complexity | 621.0 |
Chemical Identifiers
| CAS Number | 62445-06-1 |
|---|---|
| SMILES | C[C@H]1[C@H]([C@@H]2[C@@H](O2)C3=CC(=O)C4(C[C@]13C)C(O4)(C)C)OC(=O)C |
| InChIKey | NQRGNSMJSDQOED-MMYXWLFWSA-N |
Product Overview
Eremofortin A (CAS 62445-06-1), with molecular formula C17H22O5 and molecular weight 306.15 g/mol. IUPAC: [(1aR,2R,3R,3aR,7bS)-3,3',3',3a-tetramethyl-6-oxospiro[2,3,4,7b-tetrahydro-1aH-naphtho[1,2-b]oxirene-5,2'-oxirane]-2-yl] acetate.
Chemical Property Profile of Eremofortin A
Property Insights of Eremofortin A
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Eremofortin A. The TPSA of 68.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Eremofortin A. Following Lipinski's Rule of Five, Eremofortin A has 0 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 Eremofortin A?
The CAS number of Eremofortin A is 62445-06-1.
What is the molecular formula of Eremofortin A?
The molecular formula of Eremofortin A is C17H22O5.
What is the molecular weight of Eremofortin A?
The molecular weight of Eremofortin A is 306.15 g/mol.
Where can I buy Eremofortin A?
You can request a quote for Eremofortin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Eremofortin A?
Yes, KEHONG BIO provides custom synthesis services for Eremofortin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.