Products 1365244-68-3

CAS 1365244-68-3 appears in our catalog under these names: Mirabegron M14 (YM-554028), Mirabegron N-Glucuronide. Offered by: Chemat Brand, TRC, Biosynth. Available pack sizes: on request, 50mg, 10mg.

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

(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[4-[2-[4-[2-[[(2R)-2-hydroxy-2-phenylethyl]amino]ethyl]anilino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]oxane-2-carboxylic acid (CAS 1365244-68-3) is a chemical compound with the molecular formula C27H32N4O8S and a molecular weight of 572.6 g/mol. IUPAC name: (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[4-[2-[4-[2-[[(2R)-2-hydroxy-2-phenylethyl]amino]ethyl]anilino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]oxane-2-carboxylic acid. InChIKey: YBQVFLMYXJIJCA-ZEJZDXSBSA-N.

Identity
Molecular formulaC27H32N4O8S
Molecular weight572.6 g/mol
IUPAC name(2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-[[4-[2-[4-[2-[[(2R)-2-hydroxy-2-phenylethyl]amino]ethyl]anilino]-2-oxoethyl]-1,3-thiazol-2-yl]amino]oxane-2-carboxylic acid
InChIKeyYBQVFLMYXJIJCA-ZEJZDXSBSA-N
SMILESC1=CC=C(C=C1)[C@H](CNCCC2=CC=C(C=C2)NC(=O)CC3=CSC(=N3)N[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O

Computed by PubChem (NCBI)