basic_info |
|
| Product_Name： | REDUCTIOMYCIN |
| CAS： | 68748-55-0 |
| EnglishSynonyms： | REDUCTIOMYCIN |
| pro_mdlNumber： | MFCD01939899 |
| pro_acceptors： | 7 |
| pro_donors： | 2 |
| pro_smile： | CC(=O)OC1COC=C1/C=C/C(=O)NC2=C(CCC2=O)O |
| InChi： | InChI=1S/C14H15NO6/c1-8(16)21-12-7-20-6-9(12)2-5-13(19)15-14-10(17)3-4-11(14)18/h2,5-6,12,17H,3-4,7H2,1H3,(H,15,19)/b5-2+ |
| InChiKey： | InChIKey=SMRZUCOYVJWDII-GORDUTHDSA-N |
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