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CAS 10030-88-3: β-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-, ion(1-), (R)-, 2-hydroxy-N,N,N-trimethylethanaminium

Formula:C9H16NO5·C5H14NO
InChI:InChI=1S/C9H17NO5.C5H14NO/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13;1-6(2,3)4-5-7/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13);7H,4-5H2,1-3H3/q;+1/p-1/t7-;/m0./s1
InChI key:InChIKey=HXCGBBALZREMAS-FJXQXJEOSA-M
SMILES:[C@@H](C(CO)(C)C)(C(NCCC([O-])=O)=O)O.C([N+](C)(C)C)CO
Synonyms:
  • Choline, pantothenate
  • β-Alanine, N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-, ion(1-), (R)-, 2-hydroxy-N,N,N-trimethylethanaminium
  • Ethanaminium, 2-hydroxy-N,N,N-trimethyl-, salt with (R)-N-(2,4-dihydroxy-3,3-dimethyl-1-oxobutyl)-β-alanine (1:1)
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