Candicidin D1

Base Information

• Chemical Name: Candicidin D1
• CAS No.: 1403-17-4
• Molecular Formula: C21H36O5
• Molecular Weight: 1440.69
• European Community (EC) Number: 215-763-7
• DSSTox Substance ID: DTXSID90424155
• Wikipedia: Candicidin
• NCI Thesaurus Code: C87461
• Mol file: 1403-17-4.mol

Synonyms:Candicidin D;Candicidin D1;Levorin A2;CANDICIDIN;LIA-0704;DTXSID90424155;39454-91-6;Perimycin-50-oic acid, 21-O-(3-amino-3,6-dideoxy-D-mannopyranosyl)-21-O-de(4-amino-4,6-dideoxy-D-mannopyranosyl)-N(sup 47)-demethyl-13-deoxo-3,5,7-trideoxy-13-hydroxy-40-methyl-3,7-dioxo-;LS-102437

Chemical Property of Candicidin D1

Chemical Property:

• Appearance/Colour: COA
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.609
• Boiling Point: 1273.3 °C at 760 mmHg
• Flash Point: 723.8 °C
• PSA: 97.99000
• Density: 1.3 g/cm³
• LogP: 3.43300
• Water Solubility.: 13.47g/L(21 oC)
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 11
• Hydrogen Bond Acceptor Count: 20
• Rotatable Bond Count: 10
• Exact Mass: 1108.57191383
• Heavy Atom Count: 79
• Complexity: 2130

Purity/Quality:

99%, ^*data from raw suppliers

Candicidin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical 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
• Isomeric SMILES: CC1/C=C/C=C/C=C/C=C/C=C/C=C/C=C/C(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
• Uses: Candicidin is a macrocyclic heptaene antifungal complex produced by Streptomyces griseus and isolated by Lechevalier and colleagues in 1953. The candicidin complex comprises analogues A, B, C and D, with candicidin D as the major component. Candicidin is active against fungi, in particular Candida albicans, and is used clinically to treat vaginal candidiasis. Like all polyene antifungal metabolites, candicidin acts by binding to ergosterol and disrupting the fungal membrane.