11-Deoxycandicidin D
TL;DR: 11-Deoxycandicidin D (CAS 77215-53-3) is a chemical compound with molecular formula C59H84N2O17 and molecular weight 1092.58 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
22-(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-38-[7-(4-aminophenyl)-5-hydroxy-4-methyl-7-oxoheptan-2-yl]-10,14,18,20-tetrahydroxy-37-methyl-2,4,8,16-tetraoxo-1-oxacyclooctatriaconta-23,25,27,29,31,33,35-heptaene-19-carboxylic acid
Also Known As: 11-Deoxycandicidin D
| Molecular Formula | C59H84N2O17 |
|---|---|
| Molecular Weight | 1092.58 g/mol |
| LogP | 4.6416 |
| Topological Polar Surface Area | 343.99 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 10 |
| Exact Mass | 1092.577 |
| Heavy Atoms | 78 |
| Complexity | 2272.4714 |
Chemical Identifiers
| CAS Number | 77215-53-3 |
|---|---|
| SMILES | CC1C=CC=CC=CC=CC=CC=CC=CC(CC(C(C(CC(=O)CC(CCCC(CC(=O)CCCC(=O)CC(=O)OC1C(C)CC(C)C(CC(=O)C2=CC=C(C=C2)N)O)O)O)O)C(=O)O)O)OC3C(C(C(C(O3)C)O)N)O |
Product Overview
11-Deoxycandicidin D (CAS 77215-53-3), with molecular formula C59H84N2O17 and molecular weight 1092.58 g/mol. IUPAC: 22-(4-amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-38-[7-(4-aminophenyl)-5-hydroxy-4-methyl-7-oxoheptan-2-yl]-10,14,18,20-tetrahydroxy-37-methyl-2,4,8,16-tetraoxo-1-oxacyclooctatriaconta-23,25,27,29,31,33,35-heptaene-19-carboxylic acid.
Chemical Property Profile of 11-Deoxycandicidin D
Property Insights of 11-Deoxycandicidin D
The XLogP value of 4.6416 indicates that 11-Deoxycandicidin D is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 343.99 Ų indicates high polarity, suggesting 11-Deoxycandicidin D may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 11-Deoxycandicidin D has 10 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11-Deoxycandicidin D?
The CAS number of 11-Deoxycandicidin D is 77215-53-3.
What is the molecular formula of 11-Deoxycandicidin D?
The molecular formula of 11-Deoxycandicidin D is C59H84N2O17.
What is the molecular weight of 11-Deoxycandicidin D?
The molecular weight of 11-Deoxycandicidin D is 1092.58 g/mol.
Where can I buy 11-Deoxycandicidin D?
You can request a quote for 11-Deoxycandicidin D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11-Deoxycandicidin D?
Yes, KEHONG BIO provides custom synthesis services for 11-Deoxycandicidin D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.