CAS 126049-03-4 to numer rejestracyjny substancji Napsamycin A. Oferty producentów: MedChemExpress. Dostępne opakowania: Get quote.
(2S)-2-[[(2R)-1-[[(2R,3R)-1-[[(Z)-[(4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-2-ylidene]methyl]amino]-3-[[(3R)-6-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carbonyl]-methylamino]-1-oxobutan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]carbamoylamino]-3-(3-hydroxyphenyl)propanoic acid (CAS 126049-03-4) to związek chemiczny o wzorze sumarycznym C39H48N8O12S i masie molowej 852.9 g/mol. Nazwa systematyczna IUPAC: (2S)-2-[[(2R)-1-[[(2R,3R)-1-[[(Z)-[(4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-2-ylidene]methyl]amino]-3-[[(3R)-6-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carbonyl]-methylamino]-1-oxobutan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]carbamoylamino]-3-(3-hydroxyphenyl)propanoic acid. InChIKey: XWORGFMCZJWEQG-WWAZGZIUSA-N.
| Wzór sumaryczny | C39H48N8O12S |
|---|---|
| Masa molowa | 852.9 g/mol |
| Nazwa IUPAC | (2S)-2-[[(2R)-1-[[(2R,3R)-1-[[(Z)-[(4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-hydroxyoxolan-2-ylidene]methyl]amino]-3-[[(3R)-6-hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carbonyl]-methylamino]-1-oxobutan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]carbamoylamino]-3-(3-hydroxyphenyl)propanoic acid |
| InChIKey | XWORGFMCZJWEQG-WWAZGZIUSA-N |
| SMILES | C[C@H]([C@H](C(=O)N/C=C\1/C[C@H]([C@@H](O1)N2C=CC(=O)NC2=O)O)NC(=O)[C@@H](CCSC)NC(=O)N[C@@H](CC3=CC(=CC=C3)O)C(=O)O)N(C)C(=O)[C@H]4CC5=C(CN4)C=CC(=C5)O |
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