Preussomerin A
TL;DR: Preussomerin A (CAS 129240-52-4) is a chemical compound with molecular formula C20H14O7 and molecular weight 366.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,11,21,22-tetraoxaheptacyclo[10.9.1.11,6.112,16.02,4.010,24.020,23]tetracosa-6,8,10(24),13,16(23),17,19-heptaene-5,7,15-triol
Also Known As: Preussomerin A, 3,11,21,22-Tetraoxaheptacyclo[10.9.1.11,6.112,16.02,4.010,24.020,23]tetracosa-6,8,10(24),13,16(23),17,19-heptaene-5,7,15-triol, 8a,9a-Dihydro-1H,8H-3a,9b-epoxynaphtho[1,8-bc]oxireno[2,3]naphtho[1,8-fg][1,5]dioxocine-1,7,8-triol
| Molecular Formula | C20H14O7 |
|---|---|
| Molecular Weight | 366.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 366.07394 |
| Heavy Atoms | 27 |
| Complexity | 712.0 |
Chemical Identifiers
| CAS Number | 129240-52-4 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)OC45C6C(O6)C(C7=C(C=CC(=C74)OC3(O5)C=CC2O)O)O |
| InChIKey | YYUIJBSRPPKHNR-UHFFFAOYSA-N |
Product Overview
Preussomerin A (CAS 129240-52-4), with molecular formula C20H14O7 and molecular weight 366.07 g/mol. IUPAC: 3,11,21,22-tetraoxaheptacyclo[10.9.1.11,6.112,16.02,4.010,24.020,23]tetracosa-6,8,10(24),13,16(23),17,19-heptaene-5,7,15-triol.
Chemical Property Profile of Preussomerin A
Property Insights of Preussomerin A
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Preussomerin A. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Preussomerin A. Following Lipinski's Rule of Five, Preussomerin A 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 Preussomerin A?
The CAS number of Preussomerin A is 129240-52-4.
What is the molecular formula of Preussomerin A?
The molecular formula of Preussomerin A is C20H14O7.
What is the molecular weight of Preussomerin A?
The molecular weight of Preussomerin A is 366.07 g/mol.
Where can I buy Preussomerin A?
You can request a quote for Preussomerin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Preussomerin A?
Yes, KEHONG BIO provides custom synthesis services for Preussomerin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.