Antibiotic A447 C
TL;DR: Antibiotic A447 C (CAS 95599-38-5) is a chemical compound with molecular formula C60H88N2O20 and molecular weight 1156.59 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,10-bis[[4-(dimethylamino)-5-[5-(5-hydroxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy]-9-ethyl-4,6,9,11-tetrahydroxy-8,10-dihydro-7H-tetracene-5,12-dione
Also Known As: Antibiotic A447 C, cytorhodin A, Antibiotic A447-C, 1-Deoxyobelmycin B, 7,10-bis[[4-(dimethylamino)-5-[5-(5-hydroxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy]-9-ethyl-4,6,9,11-tetrahydroxy-8,10-dihydro-7H-tetracene-5,12-dione
| Molecular Formula | C60H88N2O20 |
|---|---|
| Molecular Weight | 1156.59 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 273.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 15 |
| Exact Mass | 1156.593 |
| Heavy Atoms | 82 |
| Complexity | 2130.0 |
Chemical Identifiers
| CAS Number | 95599-38-5 |
|---|---|
| SMILES | CCC1(CC(C2=C(C1OC3CC(C(C(O3)C)OC4CCC(C(O4)C)OC5CCC(C(O5)C)O)N(C)C)C(=C6C(=C2O)C(=O)C7=C(C6=O)C=CC=C7O)O)OC8CC(C(C(O8)C)OC9CCC(C(O9)C)OC1CCC(C(O1)C)O)N(C)C)O |
| InChIKey | JCVKGZNZMVGUIP-UHFFFAOYSA-N |
Product Overview
Antibiotic A447 C (CAS 95599-38-5), with molecular formula C60H88N2O20 and molecular weight 1156.59 g/mol. IUPAC: 7,10-bis[[4-(dimethylamino)-5-[5-(5-hydroxy-6-methyloxan-2-yl)oxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy]-9-ethyl-4,6,9,11-tetrahydroxy-8,10-dihydro-7H-tetracene-5,12-dione.
Chemical Property Profile of Antibiotic A447 C
Property Insights of Antibiotic A447 C
The XLogP value of 6.1 indicates that Antibiotic A447 C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 273.0 Ų indicates high polarity, suggesting Antibiotic A447 C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Antibiotic A447 C has 6 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Antibiotic A447 C?
The CAS number of Antibiotic A447 C is 95599-38-5.
What is the molecular formula of Antibiotic A447 C?
The molecular formula of Antibiotic A447 C is C60H88N2O20.
What is the molecular weight of Antibiotic A447 C?
The molecular weight of Antibiotic A447 C is 1156.59 g/mol.
Where can I buy Antibiotic A447 C?
You can request a quote for Antibiotic A447 C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Antibiotic A447 C?
Yes, KEHONG BIO provides custom synthesis services for Antibiotic A447 C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.