basic_info |
|
| Product_Name: | 3',4',6-TRIMETHOXYISOFLAVONE-7-O-BETA-D-GLUCOPYRANOSIDE |
| CAS: | 59183-50-5 |
| EnglishSynonyms: | CLADRASTIN-7-O-BETA-D-GLUCOPYRANOSIDE ; 3',4',6-TRIMETHOXYISOFLAVONE-7-O-BETA-D-GLUCOPYRANOSIDE |
| pro_mdlNumber: | MFCD05861582 |
| pro_acceptors: | 11 |
| pro_donors: | 4 |
| pro_smile: | COc1ccc(cc1OC)c2coc3cc(c(cc3c2=O)OC)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O |
| InChi: | InChI=1S/C24H26O11/c1-30-14-5-4-11(6-16(14)31-2)13-10-33-15-8-18(17(32-3)7-12(15)20(13)26)34-24-23(29)22(28)21(27)19(9-25)35-24/h4-8,10,19,21-25,27-29H,9H2,1-3H3/t19-,21-,22+,23-,24-/m1/s1 |
| InChiKey: | InChIKey=PMHWEGVKSVMZAG-PFKOEMKTSA-N |
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