Candicidin D
TL;DR: Candicidin D (CAS 39372-30-0) is a chemical compound with molecular formula C59H84N2O18 and molecular weight 1108.57 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]-10,12,14,18,20-pentahydroxy-37-methyl-2,4,8,16-tetraoxo-1-oxacyclooctatriaconta-23,25,27,29,31,33,35-heptaene-19-carboxylic acid
Also Known As: Candicidin D, Candeptin, 22-(4-Amino-3,5-dihydroxy-6-methyloxan-2-yl)oxy-38-[7-(4-aminophenyl)-5-hydroxy-4-methyl-7-oxoheptan-2-yl]-10,12,14,18,20-pentahydroxy-37-methyl-2,4,8,16-tetraoxo-1-oxacyclooctatriaconta-23,25,27,29,31,33,35-heptaene-19-carboxylic acid
| Molecular Formula | C59H84N2O18 |
|---|---|
| Molecular Weight | 1108.57 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 364.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 20 |
| Rotatable Bonds | 10 |
| Exact Mass | 1108.5719 |
| Heavy Atoms | 79 |
| Complexity | 2130.0 |
Chemical Identifiers
| CAS Number | 39372-30-0 |
|---|---|
| SMILES | CC1C=CC=CC=CC=CC=CC=CC=CC(CC(C(C(CC(=O)CC(CC(CC(CC(=O)CCCC(=O)CC(=O)OC1C(C)CC(C)C(CC(=O)C2=CC=C(C=C2)N)O)O)O)O)O)C(=O)O)O)OC3C(C(C(C(O3)C)O)N)O |
| InChIKey | OPGSFDUODIJJGF-UHFFFAOYSA-N |
Product Overview
Candicidin D (CAS 39372-30-0), with molecular formula C59H84N2O18 and molecular weight 1108.57 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]-10,12,14,18,20-pentahydroxy-37-methyl-2,4,8,16-tetraoxo-1-oxacyclooctatriaconta-23,25,27,29,31,33,35-heptaene-19-carboxylic acid.
Chemical Property Profile of Candicidin D
Property Insights of Candicidin D
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Candicidin D. The TPSA of 364.0 Ų indicates high polarity, suggesting Candicidin D may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Candicidin D has 11 hydrogen bond donor(s) and 20 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Candicidin D?
The CAS number of Candicidin D is 39372-30-0.
What is the molecular formula of Candicidin D?
The molecular formula of Candicidin D is C59H84N2O18.
What is the molecular weight of Candicidin D?
The molecular weight of Candicidin D is 1108.57 g/mol.
Where can I buy Candicidin D?
You can request a quote for Candicidin D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Candicidin D?
Yes, KEHONG BIO provides custom synthesis services for Candicidin D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.