Bacillomycin
TL;DR: Bacillomycin (CAS 1395-21-7) is a chemical compound with molecular formula C45H68N10O15 and molecular weight 988.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3R,6R,9S,16S,19R,22S,25S)-3,9-bis(2-amino-2-oxoethyl)-16-[(1R)-1-hydroxyethyl]-19-(hydroxymethyl)-6-[(4-hydroxyphenyl)methyl]-13-octyl-2,5,8,11,15,18,21,24-octaoxo-1,4,7,10,14,17,20,23-octazabicyclo[23.3.0]octacosan-22-yl]propanoic acid
Also Known As: Subtilisins, Bacillomycin D, Bacillomycin, Subtilisin, Alcalase
| Molecular Formula | C45H68N10O15 |
|---|---|
| Molecular Weight | 988.49 g/mol |
| LogP | -3.5377 |
| Topological Polar Surface Area | 408.18 Ų |
| Hydrogen Bond Donors | 13 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 18 |
| Exact Mass | 988.4866 |
| Heavy Atoms | 70 |
| Complexity | 2036.9564 |
Chemical Identifiers
| CAS Number | 1395-21-7 |
|---|---|
| SMILES | CCCCCCCCC1CC(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N1)[C@@H](C)O)CO)CCC(=O)O)CC(=O)N)CC3=CC=C(C=C3)O)CC(=O)N |
Product Overview
Bacillomycin (CAS 1395-21-7), with molecular formula C45H68N10O15 and molecular weight 988.49 g/mol. IUPAC: 3-[(3R,6R,9S,16S,19R,22S,25S)-3,9-bis(2-amino-2-oxoethyl)-16-[(1R)-1-hydroxyethyl]-19-(hydroxymethyl)-6-[(4-hydroxyphenyl)methyl]-13-octyl-2,5,8,11,15,18,21,24-octaoxo-1,4,7,10,14,17,20,23-octazabicyclo[23.3.0]octacosan-22-yl]propanoic acid.
Chemical Property Profile of Bacillomycin
Property Insights of Bacillomycin
The XLogP value of -3.5377 indicates that Bacillomycin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 408.18 Ų indicates high polarity, suggesting Bacillomycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bacillomycin has 13 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bacillomycin?
The CAS number of Bacillomycin is 1395-21-7.
What is the molecular formula of Bacillomycin?
The molecular formula of Bacillomycin is C45H68N10O15.
What is the molecular weight of Bacillomycin?
The molecular weight of Bacillomycin is 988.49 g/mol.
Where can I buy Bacillomycin?
You can request a quote for Bacillomycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bacillomycin?
Yes, KEHONG BIO provides custom synthesis services for Bacillomycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.