CAS 1203586-72-4 appears in our catalog under these names: Cyclotraxin B, Cyclotraxin B, Cyclotraxin B, 99.78%, Cyclotraxin-B trifluoroacetate salt >= 9, Cyclotraxin B, ≥98%. Offered by: GLPBio, TargetMol, MedChemExpress, Sigma-Aldrich, Chemat. Available pack sizes: 1mg, 10mg, 5mg, 10 mg, 5 mg, 1 mg, 25mg, 50mg.
(3S,6R,11R,17S,20S,23S,26S,32S,35S)-6-amino-20-(4-aminobutyl)-3-(2-amino-2-oxoethyl)-17-(2-carboxyethyl)-23-[(1R)-1-hydroxyethyl]-26-[(4-hydroxyphenyl)methyl]-32-(2-methylsulfanylethyl)-2,5,13,16,19,22,25,28,31,34-decaoxo-8,9-dithia-1,4,12,15,18,21,24,27,30,33-decazabicyclo[33.3.0]octatriacontane-11-carboxylic acid (CAS 1203586-72-4) is a chemical compound with the molecular formula C48H73N13O17S3 and a molecular weight of 1200.4 g/mol. IUPAC name: (3S,6R,11R,17S,20S,23S,26S,32S,35S)-6-amino-20-(4-aminobutyl)-3-(2-amino-2-oxoethyl)-17-(2-carboxyethyl)-23-[(1R)-1-hydroxyethyl]-26-[(4-hydroxyphenyl)methyl]-32-(2-methylsulfanylethyl)-2,5,13,16,19,22,25,28,31,34-decaoxo-8,9-dithia-1,4,12,15,18,21,24,27,30,33-decazabicyclo[33.3.0]octatriacontane-11-carboxylic acid. InChIKey: JLBMMJHZUYBFGX-ZHTCEXBHSA-N.
| Molecular formula | C48H73N13O17S3 |
|---|---|
| Molecular weight | 1200.4 g/mol |
| IUPAC name | (3S,6R,11R,17S,20S,23S,26S,32S,35S)-6-amino-20-(4-aminobutyl)-3-(2-amino-2-oxoethyl)-17-(2-carboxyethyl)-23-[(1R)-1-hydroxyethyl]-26-[(4-hydroxyphenyl)methyl]-32-(2-methylsulfanylethyl)-2,5,13,16,19,22,25,28,31,34-decaoxo-8,9-dithia-1,4,12,15,18,21,24,27,30,33-decazabicyclo[33.3.0]octatriacontane-11-carboxylic acid |
| InChIKey | JLBMMJHZUYBFGX-ZHTCEXBHSA-N |
| SMILES | C[C@H]([C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N1)CC3=CC=C(C=C3)O)CCSC)CC(=O)N)N)C(=O)O)CCC(=O)O)CCCCN)O |
Computed by PubChem (NCBI)