basic_info |
|
Product_Name: | RAFFINOSE MYRISTATE |
CAS: | 91433-10-2 |
EnglishSynonyms: | RAFFINOSE MYRISTATE |
pro_mdlNumber: | MFCD01742158 |
pro_acceptors: | 16 |
pro_donors: | 11 |
pro_smile: | CCCCCCCCCCCCCC(=O)O.C([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O[C@]3([C@H]([C@@H]([C@H](O3)CO)O)O)CO)O)O)O)O)O)O)O |
InChi: | InChI=1S/C18H32O16.C14H28O2/c19-1-5-8(22)11(25)13(27)16(31-5)30-3-7-9(23)12(26)14(28)17(32-7)34-18(4-21)15(29)10(24)6(2-20)33-18;1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h5-17,19-29H,1-4H2;2-13H2,1H3,(H,15,16)/t5-,6-,7-,8+,9-,10-,11+,12+,13-,14-,15+,16+,17-,18+;/m1./s1 |
InChiKey: | InChIKey=RDTYBBPDUXBXQV-RHSPYTNDSA-N |
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