Mitraphyllic acid
TL;DR: Mitraphyllic acid (CAS 109350-28-9) is a chemical compound with molecular formula C20H22N2O4 and molecular weight 354.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Mitraphyllic acid
(1S,4aS,5aS,6R,10aR)-1-methyl-2'-oxospiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylic acid
Also Known As: Mitraphyllic acid, Isomitraphyllic acid, mitraphyllinic acid, KST-1A0501, (19
| Molecular Formula | C20H22N2O4 |
|---|---|
| Molecular Weight | 354.16 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 354.15796 |
| Heavy Atoms | 26 |
| Complexity | 677.0 |
Chemical Identifiers
| CAS Number | 109350-28-9 |
|---|---|
| SMILES | C[C@H]1[C@H]2CN3CC[C@]4([C@@H]3C[C@@H]2C(=CO1)C(=O)O)C5=CC=CC=C5NC4=O |
| InChIKey | BLXUPISDXRFTCK-GALDEACFSA-N |
Product Overview
Mitraphyllic acid (CAS 109350-28-9), with molecular formula C20H22N2O4 and molecular weight 354.16 g/mol. IUPAC: (1S,4aS,5aS,6R,10aR)-1-methyl-2'-oxospiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylic acid.
Chemical Property Profile of Mitraphyllic acid
Property Insights of Mitraphyllic acid
The XLogP value of -1.0 indicates that Mitraphyllic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Mitraphyllic acid. Following Lipinski's Rule of Five, Mitraphyllic acid has 2 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 Mitraphyllic acid?
The CAS number of Mitraphyllic acid is 109350-28-9.
What is the molecular formula of Mitraphyllic acid?
The molecular formula of Mitraphyllic acid is C20H22N2O4.
What is the molecular weight of Mitraphyllic acid?
The molecular weight of Mitraphyllic acid is 354.16 g/mol.
Where can I buy Mitraphyllic acid?
You can request a quote for Mitraphyllic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mitraphyllic acid?
Yes, KEHONG BIO provides custom synthesis services for Mitraphyllic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.