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Stereoisomer #6

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TieuLongPhan opened this issue Dec 13, 2023 · 0 comments

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TieuLongPhan commented Dec 13, 2023

Hydrogenation
{'id': 'US20110060146A1',
'class': 7,
'reactions': 'CCC(CC)(c1ccc(O)c(C)c1)c1ccc(C#CC2(O)CCCC2)c(C)c1>>CCC(CC)(c1ccc(O)c(C)c1)c1ccc(/C=C/C2(O)CCCC2)c(C)c1',
'reactants': 'CCC(CC)(c1ccc(O)c(C)c1)c1ccc(C#CC2(O)CCCC2)c(C)c1.[HH]',
'products': 'CCC(CC)(c1ccc(O)c(C)c1)c1ccc(/C=C/C2(O)CCCC2)c(C)c1',
'standardized_reactants': nan,
'standardized_products': nan,
'Unbalance': 'Reactants',
'Diff_formula': {'H': 2, 'Q': 0},
'new_reaction': 'CCC(CC)(c1ccc(O)c(C)c1)c1ccc(C#CC2(O)CCCC2)c(C)c1.[HH]>>CCC(CC)(c1ccc(O)c(C)c1)c1ccc(/C=C/C2(O)CCCC2)c(C)c1'}

The product is E-isomer so it should be Na+NH3 instead of H2

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