Products 1075240-42-4

CAS 1075240-42-4 is the registry number for N-Methylol Omadacycline. Offered by: TRC. Available pack sizes: 5mg.

Structural formula: {0} (CAS {1})

(4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-9-[(2,2-dimethylpropylamino)methyl]-1,10,11,12a-tetrahydroxy-N-(hydroxymethyl)-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide (CAS 1075240-42-4) is a chemical compound with the molecular formula C30H42N4O8 and a molecular weight of 586.7 g/mol. IUPAC name: (4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-9-[(2,2-dimethylpropylamino)methyl]-1,10,11,12a-tetrahydroxy-N-(hydroxymethyl)-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide. InChIKey: IVWLXDUNGLKXOR-YJUULGSPSA-N.

Identity
Molecular formulaC30H42N4O8
Molecular weight586.7 g/mol
IUPAC name(4S,4aS,5aR,12aR)-4,7-bis(dimethylamino)-9-[(2,2-dimethylpropylamino)methyl]-1,10,11,12a-tetrahydroxy-N-(hydroxymethyl)-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide
InChIKeyIVWLXDUNGLKXOR-YJUULGSPSA-N
SMILESCC(C)(C)CNCC1=CC(=C2C[C@H]3C[C@H]4[C@@H](C(=O)C(=C([C@]4(C(=O)C3=C(C2=C1O)O)O)O)C(=O)NCO)N(C)C)N(C)C

Computed by PubChem (NCBI)