basic_info |
|
| Product_Name: | DELPHINIDIN-3-O-SAMBUBIOSIDE CHLORIDE |
| CAS: | 53158-73-9 |
| EnglishSynonyms: | DELPHINIDIN-3-O-SAMBUBIOSIDE CHLORIDE |
| pro_mdlNumber: | MFCD10566018 |
| pro_acceptors: | 16 |
| pro_donors: | 11 |
| pro_smile: | c1c(cc(c(c1O)O)O)c2c(cc3c(cc(cc3[o+]2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO[C@H]5[C@@H]([C@H]([C@@H](CO5)O)O)O)O)O)O.[Cl-] |
| InChi: | InChI=1S/C26H28O16.ClH/c27-9-3-11(28)10-5-16(24(40-15(10)4-9)8-1-12(29)18(32)13(30)2-8)41-26-23(37)21(35)20(34)17(42-26)7-39-25-22(36)19(33)14(31)6-38-25;/h1-5,14,17,19-23,25-26,31,33-37H,6-7H2,(H4-,27,28,29,30,32);1H/t14-,17-,19+,20-,21+,22-,23-,25+,26-;/m1./s1 |
| InChiKey: | InChIKey=QKTJGNLRUZWYSE-BSHOCNPGSA-N |
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