basic_info |
|
| Product_Name: | 苋菜红甙 |
| CAS: | 15167-84-7 |
| 中文同义词: | 苋菜红甙 |
| EnglishSynonyms: | AMARANTHIN |
| pro_mdlNumber: | MFCD13194953 |
| pro_acceptors: | 21 |
| pro_donors: | 11 |
| pro_smile: | c1c2c(cc(c1O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)C(=O)O)O)O)O)O)N([C@@H](C2)C(=O)O)/C=C/C5=CC(=N[C@@H](C5)C(=O)O)C(=O)O |
| InChi: | InChI=1S/C30H34N2O19/c33-8-17-18(35)20(37)24(51-29-22(39)19(36)21(38)23(50-29)28(46)47)30(49-17)48-16-6-10-5-14(27(44)45)32(13(10)7-15(16)34)2-1-9-3-11(25(40)41)31-12(4-9)26(42)43/h1-3,6-7,12,14,17-24,29-30,33-39H,4-5,8H2,(H,40,41)(H,42,43)(H,44,45)(H,46,47)/b2-1+/t12-,14-,17+,18+,19-,20-,21-,22+,23-,24+,29-,30+/m0/s1 |
| InChiKey: | InChIKey=HNGVOGUQLNOBKK-VSISWFCLSA-N |
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