Products 135882-23-4

CAS 135882-23-4 is the registry number for Pneumocandin A4. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

N-[3-(3-amino-1-hydroxy-3-oxopropyl)-11,25-dihydroxy-15-(1-hydroxyethyl)-6-[2-(4-hydroxyphenyl)ethyl]-26-methyl-2,5,8,14,17,23-hexaoxo-1,4,7,13,16,22-hexazatricyclo[22.3.0.09,13]heptacosan-18-yl]-10,12-dimethyltetradecanamide (CAS 135882-23-4) is a chemical compound with the molecular formula C51H82N8O13 and a molecular weight of 1015.2 g/mol. IUPAC name: N-[3-(3-amino-1-hydroxy-3-oxopropyl)-11,25-dihydroxy-15-(1-hydroxyethyl)-6-[2-(4-hydroxyphenyl)ethyl]-26-methyl-2,5,8,14,17,23-hexaoxo-1,4,7,13,16,22-hexazatricyclo[22.3.0.09,13]heptacosan-18-yl]-10,12-dimethyltetradecanamide. InChIKey: XYZCJMODJVDCJD-UHFFFAOYSA-N.

Identity
Molecular formulaC51H82N8O13
Molecular weight1015.2 g/mol
IUPAC nameN-[3-(3-amino-1-hydroxy-3-oxopropyl)-11,25-dihydroxy-15-(1-hydroxyethyl)-6-[2-(4-hydroxyphenyl)ethyl]-26-methyl-2,5,8,14,17,23-hexaoxo-1,4,7,13,16,22-hexazatricyclo[22.3.0.09,13]heptacosan-18-yl]-10,12-dimethyltetradecanamide
InChIKeyXYZCJMODJVDCJD-UHFFFAOYSA-N
SMILESCCC(C)CC(C)CCCCCCCCC(=O)NC1CCCNC(=O)C2C(C(CN2C(=O)C(NC(=O)C(NC(=O)C3CC(CN3C(=O)C(NC1=O)C(C)O)O)CCC4=CC=C(C=C4)O)C(CC(=O)N)O)C)O

Computed by PubChem (NCBI)

Synonyms: orb3023964