pimaricin
TL;DR: pimaricin (CAS 52882-37-8) is a chemical compound with molecular formula C33H47NO13 and molecular weight 665.30 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-18,20,24-trihydroxy-6-methyl-4,22-dioxo-5,27-dioxabicyclo[24.1.0]heptacosa-2,8,10,12,14-pentaene-19-carboxylic acid
Also Known As: pimaricin, 11-(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-3,7,9-trihydroxy-21-methyl-5,23-dioxo-22,27-dioxabicyclo[24.1.0]heptacosa-12,14,16,18,24-pentaene-8-carboxylic acid, 16-(4-Amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-18,20,24-trihydroxy-6-methyl-4,22-dioxo-5,27-dioxabicyclo[24.1.0]heptacosa-2,8,10,12,14-pentaene-19-carboxylic acid, 16-[(3-Amino-3,6-dideoxyhexopyranosyl)oxy]-18,20,24-trihydroxy-6-methyl-4,22-dioxo-5,27-dioxabicyclo[24.1.0]heptacosa-2,8,10,12,14-pentaene-19-carboxylic acid
| Molecular Formula | C33H47NO13 |
|---|---|
| Molecular Weight | 665.30 g/mol |
| LogP | -0.0377 |
| Topological Polar Surface Area | 238.83 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 3 |
| Exact Mass | 665.30475 |
| Heavy Atoms | 47 |
| Complexity | 1198.9136 |
Chemical Identifiers
| CAS Number | 52882-37-8 |
|---|---|
| SMILES | CC1CC=CC=CC=CC=CC(CC(C(C(CC(=O)CC(CC2C(O2)C=CC(=O)O1)O)O)C(=O)O)O)OC3C(C(C(C(O3)C)O)N)O |
Product Overview
pimaricin (CAS 52882-37-8), with molecular formula C33H47NO13 and molecular weight 665.30 g/mol. IUPAC: 16-(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-18,20,24-trihydroxy-6-methyl-4,22-dioxo-5,27-dioxabicyclo[24.1.0]heptacosa-2,8,10,12,14-pentaene-19-carboxylic acid.
Chemical Property Profile of pimaricin
Property Insights of pimaricin
The XLogP value of -0.0377 indicates that pimaricin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 238.83 Ų indicates high polarity, suggesting pimaricin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, pimaricin has 7 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of pimaricin?
The CAS number of pimaricin is 52882-37-8.
What is the molecular formula of pimaricin?
The molecular formula of pimaricin is C33H47NO13.
What is the molecular weight of pimaricin?
The molecular weight of pimaricin is 665.30 g/mol.
Where can I buy pimaricin?
You can request a quote for pimaricin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for pimaricin?
Yes, KEHONG BIO provides custom synthesis services for pimaricin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.