CAS 137442-16-1 is the registry number for SNF-8814. Offered by: MedChemExpress. Available pack sizes: Get quote.
(3S)-3-amino-4-[[(2S,3R)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]-methylamino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxobutan-2-yl]amino]-4-oxobutanoic acid (CAS 137442-16-1) is a chemical compound with the molecular formula C56H68N10O13 and a molecular weight of 1089.2 g/mol. IUPAC name: (3S)-3-amino-4-[[(2S,3R)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]-methylamino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxobutan-2-yl]amino]-4-oxobutanoic acid. InChIKey: KPCINFLGUVQMLR-ZELKHWSYSA-N.
| Molecular formula | C56H68N10O13 |
|---|---|
| Molecular weight | 1089.2 g/mol |
| IUPAC name | (3S)-3-amino-4-[[(2S,3R)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]-methylamino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxobutan-2-yl]amino]-4-oxobutanoic acid |
| InChIKey | KPCINFLGUVQMLR-ZELKHWSYSA-N |
| SMILES | CCCC[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N)N(C)C(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)CNC(=O)[C@H](CC4=CC=CC=C4)NC(=O)[C@H]([C@H](C)C5=CC=C(C=C5)O)NC(=O)[C@H](CC(=O)O)N |
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