basic_info |
|
| Product_Name: | N-ACETYL-L-3-NITROTYROSINE ETHYL ESTER |
| CAS: | 40642-95-3 |
| EnglishSynonyms: | N-ACETYL-L-3-NITROTYROSINE ETHYL ESTER |
| pro_mdlNumber: | MFCD00057592 |
| pro_acceptors: | 8 |
| pro_donors: | 2 |
| pro_smile: | CCOC(=O)[C@H](Cc1ccc(c(c1)[N+](=O)[O-])O)NC(=O)C |
| InChi: | InChI=1S/C13H16N2O6/c1-3-21-13(18)10(14-8(2)16)6-9-4-5-12(17)11(7-9)15(19)20/h4-5,7,10,17H,3,6H2,1-2H3,(H,14,16)/t10-/m0/s1 |
| InChiKey: | InChIKey=VFDMIQARHVLPBK-JTQLQIEISA-N |
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