basic_info |
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Product_Name: | 1,4,6-TRI-O-BUTYRYL-MYO-INOSITOL 2,3,5-TRISPHOSPHATE-HEXAKIS(ACETOXYMETHYL) ESTER |
EnglishSynonyms: | 1,4,6-TRI-O-BUTYRYL-MYO-INOSITOL 2,3,5-TRISPHOSPHATE-HEXAKIS(ACETOXYMETHYL) ESTER ; BT3-INS (2,3,5)P3/AM |
pro_mdlNumber: | MFCD08061863 |
pro_acceptors: | 30 |
pro_donors: | 0 |
pro_smile: | CCCC(=O)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H]([C@@H]1OP(=O)(OCOC(=O)C)OCOC(=O)C)OC(=O)CCC)OP(=O)(OCOC(=O)C)OCOC(=O)C)OP(=O)(OCOC(=O)C)OCOC(=O)C)OC(=O)CCC |
InChi: | InChI=1S/C36H57O30P3/c1-10-13-28(43)61-31-32(62-29(44)14-11-2)35(65-68(47,57-18-51-24(6)39)58-19-52-25(7)40)36(66-69(48,59-20-53-26(8)41)60-21-54-27(9)42)33(63-30(45)15-12-3)34(31)64-67(46,55-16-49-22(4)37)56-17-50-23(5)38/h31-36H,10-21H2,1-9H3/t31-,32-,33-,34+,35-,36+/m0/s1 |
InChiKey: | InChIKey=GJTDEMVNNQNVCM-XBWXEZBPSA-N |
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