Cepacidine A
TL;DR: Cepacidine A (CAS 19394-08-2) is a chemical compound with molecular formula C52H85N11O22 and molecular weight 1215.59 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[25-amino-22-(2-amino-1-hydroxy-2-oxoethyl)-19-[6-amino-4-hydroxy-2-(3,4,5-trihydroxyoxan-2-yl)oxypentadecyl]-12-[hydroxy-(4-hydroxyphenyl)methyl]-6,15-bis(hydroxymethyl)-2,5,8,11,14,17,21,24-octaoxo-1,4,7,10,13,16,20,23-octazacycloheptacos-9-yl]acetic acid
Also Known As: Cepacidine A, Cepacidin A, KST-1A2420, 2-[25-amino-22-(2-amino-1-hydroxy-2-oxoethyl)-19-[6-amino-4-hydroxy-2-(3,4,5-trihydroxyoxan-2-yl)oxypentadecyl]-12-[hydroxy-(4-hydroxyphenyl)methyl]-6,15-bis(hydroxymethyl)-2,5,8,11,14,17,21,24-octaoxo-1,4,7,10,13,16,20,23-octazacycloheptacos-9-yl]acetic acid, [25-amino-22-(2-amino-1-hydroxy-2-oxoethyl)-19-[6-amino-4-hydroxy-2-(pentopyranosyloxy)pentadecyl]-12-[hydroxy(4-hydroxyphenyl)methyl]-6,15-bis(hydroxymethyl)-2,5,8,11,14,17,21,24-octaoxo-1,4,7,10,13,16,20,23-octaazacycloheptacosan-9-yl]acetic acid
| Molecular Formula | C52H85N11O22 |
|---|---|
| Molecular Weight | 1215.59 g/mol |
| LogP | -6.9 |
| Topological Polar Surface Area | 566.0 Ų |
| Hydrogen Bond Donors | 21 |
| Hydrogen Bond Acceptors | 24 |
| Rotatable Bonds | 24 |
| Exact Mass | 1215.587 |
| Heavy Atoms | 85 |
| Complexity | 2180.0 |
Chemical Identifiers
| CAS Number | 19394-08-2 |
|---|---|
| SMILES | CCCCCCCCCC(CC(CC(CC1CC(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NCCC(C(=O)NC(C(=O)N1)C(C(=O)N)O)N)CO)CC(=O)O)C(C2=CC=C(C=C2)O)O)CO)OC3C(C(C(CO3)O)O)O)O)N |
| InChIKey | AHNDNUVPXFPPIH-UHFFFAOYSA-N |
Product Overview
Cepacidine A (CAS 19394-08-2), with molecular formula C52H85N11O22 and molecular weight 1215.59 g/mol. IUPAC: 2-[25-amino-22-(2-amino-1-hydroxy-2-oxoethyl)-19-[6-amino-4-hydroxy-2-(3,4,5-trihydroxyoxan-2-yl)oxypentadecyl]-12-[hydroxy-(4-hydroxyphenyl)methyl]-6,15-bis(hydroxymethyl)-2,5,8,11,14,17,21,24-octaoxo-1,4,7,10,13,16,20,23-octazacycloheptacos-9-yl]acetic acid.
Chemical Property Profile of Cepacidine A
Property Insights of Cepacidine A
The XLogP value of -6.9 indicates that Cepacidine A is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 566.0 Ų indicates high polarity, suggesting Cepacidine A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cepacidine A has 21 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cepacidine A?
The CAS number of Cepacidine A is 19394-08-2.
What is the molecular formula of Cepacidine A?
The molecular formula of Cepacidine A is C52H85N11O22.
What is the molecular weight of Cepacidine A?
The molecular weight of Cepacidine A is 1215.59 g/mol.
Where can I buy Cepacidine A?
You can request a quote for Cepacidine A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cepacidine A?
Yes, KEHONG BIO provides custom synthesis services for Cepacidine A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.