Boholmycin
TL;DR: Boholmycin (CAS 13648-32-3) is a chemical compound with molecular formula C27H48N4O21 and molecular weight 764.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-carbamoyloxy-2-[5-[6-(1,2-dihydroxyethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-3-(methylamino)oxan-2-yl]oxy-3,6-dihydroxycyclohexyl] carbamate
Also Known As: Boholmycin, BMY 28321, BU 2589, 5-hydroxy-5-trifluoromethyltetrahydro-2-furanone, [4-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-carbamoyloxy-2-[5-[6-(1,2-dihydroxyethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-3-(methylamino)oxan-2-yl]oxy-3,6-dihydroxycyclohexyl] carbamate
| Molecular Formula | C27H48N4O21 |
|---|---|
| Molecular Weight | 764.28 g/mol |
| LogP | -9.0 |
| Topological Polar Surface Area | 421.0 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 23 |
| Rotatable Bonds | 14 |
| Exact Mass | 764.2811 |
| Heavy Atoms | 52 |
| Complexity | 1180.0 |
Chemical Identifiers
| CAS Number | 13648-32-3 |
|---|---|
| SMILES | CNC1C(C(COC1OC2C(C(C(C(C2OC(=O)N)O)OC(=O)N)OC3C(C(C(C(O3)CO)O)N)O)O)OC4C(C(C(C(O4)C(CO)O)O)O)O)O |
| InChIKey | JPGBWUBDJIISRF-UHFFFAOYSA-N |
Product Overview
Boholmycin (CAS 13648-32-3), with molecular formula C27H48N4O21 and molecular weight 764.28 g/mol. IUPAC: [4-[4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5-carbamoyloxy-2-[5-[6-(1,2-dihydroxyethyl)-3,4,5-trihydroxyoxan-2-yl]oxy-4-hydroxy-3-(methylamino)oxan-2-yl]oxy-3,6-dihydroxycyclohexyl] carbamate.
Chemical Property Profile of Boholmycin
Property Insights of Boholmycin
The XLogP value of -9.0 indicates that Boholmycin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 421.0 Ų indicates high polarity, suggesting Boholmycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Boholmycin has 15 hydrogen bond donor(s) and 23 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Boholmycin?
The CAS number of Boholmycin is 13648-32-3.
What is the molecular formula of Boholmycin?
The molecular formula of Boholmycin is C27H48N4O21.
What is the molecular weight of Boholmycin?
The molecular weight of Boholmycin is 764.28 g/mol.
Where can I buy Boholmycin?
You can request a quote for Boholmycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boholmycin?
Yes, KEHONG BIO provides custom synthesis services for Boholmycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.