basic_info |
|
| Product_Name: | LINOCINAMARIN |
| CAS: | 554-87-0 |
| EnglishSynonyms: | LINOCINAMARIN |
| pro_mdlNumber: | MFCD06656308 |
| pro_acceptors: | 17 |
| pro_donors: | 11 |
| pro_smile: | c1cc(ccc1c2c(c(=O)c3c(cc(c(c3o2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O |
| InChi: | InChI=1S/C27H30O17/c28-6-12-15(33)18(36)20(38)26(40-12)43-23-11(32)5-10(31)14-17(35)25(22(42-24(14)23)8-1-3-9(30)4-2-8)44-27-21(39)19(37)16(34)13(7-29)41-27/h1-5,12-13,15-16,18-21,26-34,36-39H,6-7H2/t12-,13-,15-,16-,18+,19+,20-,21-,26+,27+/m1/s1 |
| InChiKey: | InChIKey=VMOKZQAQPBUNRW-PXJYGDGDSA-N |
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