Products 2682939-57-5
CAS 2682939-57-5 is the registry number for Mal-N(Me)-C6-N(Me)-PNU-159682. Offered by: MedChemExpress. Available pack sizes: Get quote.
[2-oxo-2-[(2S,4S)-2,5,12-trihydroxy-7-methoxy-4-[[(2S,4R,6S,7S,9R,10S)-10-methoxy-6-methyl-5,8,11-trioxa-1-azatricyclo[7.4.0.02,7]tridecan-4-yl]oxy]-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]ethyl] N-[6-[[2-(2,5-dioxopyrrol-1-yl)acetyl]-methylamino]hexyl]-N-methylcarbamate (CAS 2682939-57-5) is a chemical compound with the molecular formula C47H56N4O17 and a molecular weight of 949.0 g/mol. IUPAC name: [2-oxo-2-[(2S,4S)-2,5,12-trihydroxy-7-methoxy-4-[[(2S,4R,6S,7S,9R,10S)-10-methoxy-6-methyl-5,8,11-trioxa-1-azatricyclo[7.4.0.02,7]tridecan-4-yl]oxy]-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]ethyl] N-[6-[[2-(2,5-dioxopyrrol-1-yl)acetyl]-methylamino]hexyl]-N-methylcarbamate. InChIKey: DIKMHCCERKPKSJ-JDVHNQELSA-N.
| Molecular formula | C47H56N4O17 |
|---|---|
| Molecular weight | 949.0 g/mol |
| IUPAC name | [2-oxo-2-[(2S,4S)-2,5,12-trihydroxy-7-methoxy-4-[[(2S,4R,6S,7S,9R,10S)-10-methoxy-6-methyl-5,8,11-trioxa-1-azatricyclo[7.4.0.02,7]tridecan-4-yl]oxy]-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]ethyl] N-[6-[[2-(2,5-dioxopyrrol-1-yl)acetyl]-methylamino]hexyl]-N-methylcarbamate |
| InChIKey | DIKMHCCERKPKSJ-JDVHNQELSA-N |
| SMILES | C[C@H]1[C@@H]2[C@H](C[C@@H](O1)O[C@H]3C[C@@](CC4=C3C(=C5C(=C4O)C(=O)C6=C(C5=O)C(=CC=C6)OC)O)(C(=O)COC(=O)N(C)CCCCCCN(C)C(=O)CN7C(=O)C=CC7=O)O)N8CCO[C@@H]([C@H]8O2)OC |
Computed by PubChem (NCBI)
Synonyms:
orb3028351, Mal-N(Me)-C6-N(Me)-PNU-159682