Reblastatin
TL;DR: Reblastatin (CAS 199333-57-8) is a chemical compound with molecular formula C29H44N2O8 and molecular weight 548.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(4E,8S,9S,10E,12S,13R,14S,16R)-13,20-dihydroxy-8,14,19-trimethoxy-4,10,12,16-tetramethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(22),4,10,18,20-pentaen-9-yl] carbamate
Also Known As: reblastatin, J2.654.900K, 4,5-Dihydro-18-hydroxy-18,21-dideoxo-18,21-didehydrogeldanamycin, ((4E,8S,9S,10E,12S,13R,14S,16R)-13,20-dihydroxy-8,14,19-trimethoxy-4,10,12,16-tetramethyl-3-oxo-2-azabicyclo(16.3.1)docosa-1(22),4,10,18,20-pentaen-9-yl) carbamate, (4E,8S,9S,10E,12S,13R,14S,16R)-13,20-dihydroxy-8,14,19-trimethoxy-4,10,12,16-tetramethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(21),4,10,18(22),19-pentaen-9-yl carbamate
| Molecular Formula | C29H44N2O8 |
|---|---|
| Molecular Weight | 548.31 g/mol |
| LogP | 4.0853 |
| Topological Polar Surface Area | 149.57 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 548.30975 |
| Heavy Atoms | 39 |
| Complexity | 1053.9683 |
Chemical Identifiers
| CAS Number | 199333-57-8 |
|---|---|
| SMILES | C[C@H]1C[C@@H]([C@@H]([C@H](/C=C(/[C@@H]([C@H](CC/C=C(/C(=O)NC2=CC(=C(C(=C2)O)OC)C1)\C)OC)OC(=O)N)\C)C)O)OC |
Product Overview
Reblastatin (CAS 199333-57-8), with molecular formula C29H44N2O8 and molecular weight 548.31 g/mol. IUPAC: [(4E,8S,9S,10E,12S,13R,14S,16R)-13,20-dihydroxy-8,14,19-trimethoxy-4,10,12,16-tetramethyl-3-oxo-2-azabicyclo[16.3.1]docosa-1(22),4,10,18,20-pentaen-9-yl] carbamate.
Chemical Property Profile of Reblastatin
Property Insights of Reblastatin
The XLogP value of 4.0853 indicates that Reblastatin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 149.57 Ų indicates high polarity, suggesting Reblastatin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Reblastatin has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Reblastatin?
The CAS number of Reblastatin is 199333-57-8.
What is the molecular formula of Reblastatin?
The molecular formula of Reblastatin is C29H44N2O8.
What is the molecular weight of Reblastatin?
The molecular weight of Reblastatin is 548.31 g/mol.
Where can I buy Reblastatin?
You can request a quote for Reblastatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Reblastatin?
Yes, KEHONG BIO provides custom synthesis services for Reblastatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.