CAS 107807-25-0 to numer rejestracyjny substancji Epelmycin A. Oferty producentów: MedChemExpress. Dostępne opakowania: Get quote.
Methyl (1S,2R,4S)-4-[(2S,4R,5S,6S)-4-(dimethylamino)-6-methyl-5-[(2S,5S,6S)-6-methyl-5-[(2R,6S)-6-methyl-5-oxooxan-2-yl]oxyoxan-2-yl]oxyoxan-2-yl]oxy-2-ethyl-2,5,7,12-tetrahydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate (CAS 107807-25-0) to związek chemiczny o wzorze sumarycznym C42H53NO15 i masie molowej 811.9 g/mol. Nazwa systematyczna IUPAC: methyl (1S,2R,4S)-4-[(2S,4R,5S,6S)-4-(dimethylamino)-6-methyl-5-[(2S,5S,6S)-6-methyl-5-[(2R,6S)-6-methyl-5-oxooxan-2-yl]oxyoxan-2-yl]oxyoxan-2-yl]oxy-2-ethyl-2,5,7,12-tetrahydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate. InChIKey: GSCMQULDSZTLKO-NFDDGJDISA-N.
| Wzór sumaryczny | C42H53NO15 |
|---|---|
| Masa molowa | 811.9 g/mol |
| Nazwa IUPAC | methyl (1S,2R,4S)-4-[(2S,4R,5S,6S)-4-(dimethylamino)-6-methyl-5-[(2S,5S,6S)-6-methyl-5-[(2R,6S)-6-methyl-5-oxooxan-2-yl]oxyoxan-2-yl]oxyoxan-2-yl]oxy-2-ethyl-2,5,7,12-tetrahydroxy-6,11-dioxo-3,4-dihydro-1H-tetracene-1-carboxylate |
| InChIKey | GSCMQULDSZTLKO-NFDDGJDISA-N |
| SMILES | CC[C@]1(C[C@@H](C2=C([C@@H]1C(=O)OC)C(=C3C(=C2O)C(=O)C4=C(C3=O)C=CC=C4O)O)O[C@@H]5C[C@H]([C@@H]([C@@H](O5)C)O[C@H]6CC[C@@H]([C@@H](O6)C)O[C@H]7CCC(=O)[C@@H](O7)C)N(C)C)O |
Dane obliczone przez PubChem (NCBI)