Products 166663-25-8

CAS 166663-25-8 appears in our catalog under these names: Anidulafungin, min. 95 %, 25 mg, Anidulafungin, 95%, Anidulafungin, Anidulafungin, >95% (HPLC), Anidulafungin/ 99.15% (existing batch purity). Offered by: Roth, Combi-blocks, Chemat Brand, TRC, TargetMol. Available pack sizes: 25mg, 100mg, on request, 10mg, 5mg, 2mg, 50mg, 250mg.

Structural formula: {0} (CAS {1})

Anidulafungin is a semisynthetic echinocandin anti-fungal drug. It is active against Aspergillus and Candida species and is used for the treatment of invasive candidiasis. It is a heterodetic cyclic peptide, an azamacrocycle, an echinocandin, a semisynthetic derivative and an antibiotic antifungal drug.

Source: ChEBI

Identity
Molecular formulaC58H73N7O17
Molecular weight1140.2 g/mol
IUPAC nameN-[(3S,6S,9S,11R,15S,18S,20R,21R,24S,25S,26S)-6-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-11,20,21,25-tetrahydroxy-3,15-bis[(1R)-1-hydroxyethyl]-26-methyl-2,5,8,14,17,23-hexaoxo-1,4,7,13,16,22-hexazatricyclo[22.3.0.09,13]heptacosan-18-yl]-4-[4-(4-pentoxyphenyl)phenyl]benzamide
InChIKeyJHVAMHSQVVQIOT-MFAJLEFUSA-N
SMILESCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)N[C@H]4C[C@H]([C@H](NC(=O)[C@@H]5[C@H]([C@H](CN5C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]6C[C@H](CN6C(=O)[C@@H](NC4=O)[C@@H](C)O)O)[C@@H]([C@H](C7=CC=C(C=C7)O)O)O)[C@@H](C)O)C)O)O)O

Computed by PubChem (NCBI)