basic_info |
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Product_Name: | 1-ISOQUINOLINEACETIC ACID, 1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-, (1S)- |
CAS: | 1139908-79-4 |
EnglishSynonyms: | 1-ISOQUINOLINEACETIC ACID, 1,2,3,4-TETRAHYDRO-6,7-DIMETHOXY-, (1S)- |
pro_mdlNumber: | MFCD13194164 |
pro_acceptors: | 5 |
pro_donors: | 2 |
pro_smile: | COc1cc2c(cc1OC)[C@@H](NCC2)CC(=O)O |
InChi: | InChI=1S/C13H17NO4/c1-17-11-5-8-3-4-14-10(7-13(15)16)9(8)6-12(11)18-2/h5-6,10,14H,3-4,7H2,1-2H3,(H,15,16)/t10-/m0/s1 |
InChiKey: | InChIKey=UEXHGUMUCVTSNK-JTQLQIEISA-N |
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