Mepartricin B
TL;DR: Mepartricin B (CAS 62534-69-4) is a chemical compound with molecular formula C59H86N2O19 and molecular weight 1126.58 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 33-(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-17-[7-(4-aminophenyl)-5-hydroxy-7-oxoheptan-2-yl]-1,3,5,7,9,13,37-heptahydroxy-18-methyl-11,15-dioxo-16,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylate
Also Known As: Mepartricin B, Methyl 33-[(3-amino-3,6-dideoxyhexopyranosyl)oxy]-17-[7-(4-aminophenyl)-5-hydroxy-7-oxoheptan-2-yl]-1,3,5,7,9,13,37-heptahydroxy-18-methyl-11,15-dioxo-16,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylate
| Molecular Formula | C59H86N2O19 |
|---|---|
| Molecular Weight | 1126.58 g/mol |
| LogP | 2.3748 |
| Topological Polar Surface Area | 368.77 Ų |
| Hydrogen Bond Donors | 12 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 10 |
| Exact Mass | 1126.5825 |
| Heavy Atoms | 80 |
| Complexity | 2302.2197 |
Chemical Identifiers
| CAS Number | 62534-69-4 |
|---|---|
| SMILES | CC1C=CC=CC=CC=CC=CC=CC=CC(CC2C(C(CC(O2)(CC(CC(CC(CC(CC(=O)CC(CC(=O)OC1C(C)CCC(CC(=O)C3=CC=C(C=C3)N)O)O)O)O)O)O)O)O)C(=O)OC)OC4C(C(C(C(O4)C)O)N)O |
Product Overview
Mepartricin B (CAS 62534-69-4), with molecular formula C59H86N2O19 and molecular weight 1126.58 g/mol. IUPAC: methyl 33-(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-17-[7-(4-aminophenyl)-5-hydroxy-7-oxoheptan-2-yl]-1,3,5,7,9,13,37-heptahydroxy-18-methyl-11,15-dioxo-16,39-dioxabicyclo[33.3.1]nonatriaconta-19,21,23,25,27,29,31-heptaene-36-carboxylate.
Chemical Property Profile of Mepartricin B
Property Insights of Mepartricin B
The XLogP value of 2.3748 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mepartricin B. The TPSA of 368.77 Ų indicates high polarity, suggesting Mepartricin B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Mepartricin B has 12 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Mepartricin B?
The CAS number of Mepartricin B is 62534-69-4.
What is the molecular formula of Mepartricin B?
The molecular formula of Mepartricin B is C59H86N2O19.
What is the molecular weight of Mepartricin B?
The molecular weight of Mepartricin B is 1126.58 g/mol.
Where can I buy Mepartricin B?
You can request a quote for Mepartricin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mepartricin B?
Yes, KEHONG BIO provides custom synthesis services for Mepartricin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.