Products 2553413-13-9
CAS 2553413-13-9 is the registry number for m-PEG8-Lys(Mal)-Val-Ala-PAB-Ph-CO-Dazostinag. Offered by: MedChemExpress. Available pack sizes: Get quote.
[4-[[(2S)-2-[[(2S)-2-[[(2S)-6-(2,5-dioxopyrrol-1-yl)-2-[3-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]hexanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]phenyl]methyl N-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-9-fluoro-17-(5-fluoro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-7-yl)-12,18-dihydroxy-3-oxo-3-sulfanyl-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3lambda5,12lambda5-diphosphatricyclo[13.2.1.06,10]octadecan-8-yl]purin-6-yl]carbamoyl]phenyl]methyl]-N-methylcarbamate (CAS 2553413-13-9) is a chemical compound with the molecular formula C74H98F2N14O27P2S2 and a molecular weight of 1779.7 g/mol. IUPAC name: [4-[[(2S)-2-[[(2S)-2-[[(2S)-6-(2,5-dioxopyrrol-1-yl)-2-[3-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]hexanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]phenyl]methyl N-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-9-fluoro-17-(5-fluoro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-7-yl)-12,18-dihydroxy-3-oxo-3-sulfanyl-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3lambda5,12lambda5-diphosphatricyclo[13.2.1.06,10]octadecan-8-yl]purin-6-yl]carbamoyl]phenyl]methyl]-N-methylcarbamate. InChIKey: KQVUDEKRNBWLRQ-UEVLTWLISA-N.
| Molecular formula | C74H98F2N14O27P2S2 |
|---|---|
| Molecular weight | 1779.7 g/mol |
| IUPAC name | [4-[[(2S)-2-[[(2S)-2-[[(2S)-6-(2,5-dioxopyrrol-1-yl)-2-[3-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]hexanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]phenyl]methyl N-[[2-[[9-[(1R,6R,8R,9R,10R,15R,17R,18R)-9-fluoro-17-(5-fluoro-4-oxo-3H-pyrrolo[2,3-d]pyrimidin-7-yl)-12,18-dihydroxy-3-oxo-3-sulfanyl-12-sulfanylidene-2,4,7,11,13,16-hexaoxa-3lambda5,12lambda5-diphosphatricyclo[13.2.1.06,10]octadecan-8-yl]purin-6-yl]carbamoyl]phenyl]methyl]-N-methylcarbamate |
| InChIKey | KQVUDEKRNBWLRQ-UEVLTWLISA-N |
| SMILES | C[C@@H](C(=O)NC1=CC=C(C=C1)COC(=O)N(C)CC2=CC=CC=C2C(=O)NC3=C4C(=NC=N3)N(C=N4)[C@H]5[C@@H]([C@H]6[C@H](O5)COP(=O)(O[C@@H]7[C@@H]([C@@H](COP(=S)(O6)O)O[C@H]7N8C=C(C9=C8N=CNC9=O)F)O)S)F)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCCCN1C(=O)C=CC1=O)NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOC |
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