Products 2724212-01-3
CAS 2724212-01-3 is the registry number for KS-133, 98.75%. Offered by: MedChemExpress. Available pack sizes: 1 mg, 5 mg, 10 mg.
(1S,4S,10S,13S,16S,22S,28R,33R,36S,46S,49S)-28-acetamido-N-[(2S)-1-[[(2S,3S)-1-amino-3-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]-13,46-bis[(4-hydroxyphenyl)methyl]-10,49-bis(2-methylpropyl)-3,9,12,15,21,27,34,38,44,47,50-undecaoxo-30,31-dithia-2,8,11,14,20,26,35,39,45,48,51-undecazapentacyclo[31.10.8.04,8.016,20.022,26]henpentacontane-36-carboxamide (CAS 2724212-01-3) is a chemical compound with the molecular formula C75H111N15O17S2 and a molecular weight of 1558.9 g/mol. IUPAC name: (1S,4S,10S,13S,16S,22S,28R,33R,36S,46S,49S)-28-acetamido-N-[(2S)-1-[[(2S,3S)-1-amino-3-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]-13,46-bis[(4-hydroxyphenyl)methyl]-10,49-bis(2-methylpropyl)-3,9,12,15,21,27,34,38,44,47,50-undecaoxo-30,31-dithia-2,8,11,14,20,26,35,39,45,48,51-undecazapentacyclo[31.10.8.04,8.016,20.022,26]henpentacontane-36-carboxamide. InChIKey: FCYHSMMFZBVBRY-FEBGRODTSA-N.
| Molecular formula | C75H111N15O17S2 |
|---|---|
| Molecular weight | 1558.9 g/mol |
| IUPAC name | (1S,4S,10S,13S,16S,22S,28R,33R,36S,46S,49S)-28-acetamido-N-[(2S)-1-[[(2S,3S)-1-amino-3-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]-13,46-bis[(4-hydroxyphenyl)methyl]-10,49-bis(2-methylpropyl)-3,9,12,15,21,27,34,38,44,47,50-undecaoxo-30,31-dithia-2,8,11,14,20,26,35,39,45,48,51-undecazapentacyclo[31.10.8.04,8.016,20.022,26]henpentacontane-36-carboxamide |
| InChIKey | FCYHSMMFZBVBRY-FEBGRODTSA-N |
| SMILES | CC[C@H](C)[C@@H](C(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CC(=O)NCCCC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N3CCC[C@H]3C(=O)N4CCC[C@H]4C(=O)N[C@H](C(=O)N[C@H](C(=O)N5CCC[C@H]5C(=O)N2)CC(C)C)CC6=CC=C(C=C6)O)NC(=O)C)C(=O)N1)CC(C)C)CC7=CC=C(C=C7)O |
Computed by PubChem (NCBI)
Synonyms:
orb2664620