Products 1154758-54-9

CAS 1154758-54-9 is the registry number for Sisomicin Impurity 2. Offered by: Chemat Brand. Available pack sizes: on request.

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

(4-nitrophenyl)methyl N-[[(2S,3R)-3-amino-2-[(1R,2S,3S,4R,6S)-4,6-diamino-3-[(2R,3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-3,4-dihydro-2H-pyran-6-yl]methyl]carbamate (CAS 1154758-54-9) is a chemical compound with the molecular formula C27H42N6O11 and a molecular weight of 626.7 g/mol. IUPAC name: (4-nitrophenyl)methyl N-[[(2S,3R)-3-amino-2-[(1R,2S,3S,4R,6S)-4,6-diamino-3-[(2R,3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-3,4-dihydro-2H-pyran-6-yl]methyl]carbamate. InChIKey: VZNYBQQJPYEWCN-ADNGFLSMSA-N.

Identity
Molecular formulaC27H42N6O11
Molecular weight626.7 g/mol
IUPAC name(4-nitrophenyl)methyl N-[[(2S,3R)-3-amino-2-[(1R,2S,3S,4R,6S)-4,6-diamino-3-[(2R,3R,4R,5R)-3,5-dihydroxy-5-methyl-4-(methylamino)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-3,4-dihydro-2H-pyran-6-yl]methyl]carbamate
InChIKeyVZNYBQQJPYEWCN-ADNGFLSMSA-N
SMILESC[C@@]1(CO[C@@H]([C@@H]([C@H]1NC)O)O[C@H]2[C@@H](C[C@@H]([C@H]([C@@H]2O)O[C@@H]3[C@@H](CC=C(O3)CNC(=O)OCC4=CC=C(C=C4)[N+](=O)[O-])N)N)N)O

Computed by PubChem (NCBI)