Basic Information |
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| Product Name: | PEONIDIN-3,5-DIGLUCOSIDE CHLORIDE |
| CAS: | 132-37-6 |
| English Synonyms: | PEONIDIN-3,5-DIGLUCOSIDE CHLORIDE ; PEONIDIN 3,5-DIGLUCOSIDE ; PEONIN CHLORIDE |
| MDL Number.: | MFCD00017588 |
| H bond acceptor: | 16 |
| H bond donor: | 10 |
| Smile: | COc1cc(ccc1O)c2c(cc3c([o+]2)cc(cc3OC4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)OC5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O.[Cl-] |
| InChi: | InChI=1S/C28H32O16.ClH/c1-39-16-4-10(2-3-13(16)32)26-17(42-28-25(38)23(36)21(34)19(9-30)44-28)7-12-14(40-26)5-11(31)6-15(12)41-27-24(37)22(35)20(33)18(8-29)43-27;/h2-7,18-25,27-30,33-38H,8-9H2,1H3,(H-,31,32);1H/t18-,19-,20-,21-,22+,23+,24-,25-,27?,28?;/m1./s1 |
| InChiKey: | InChIKey=NLSMPWTZYGSAEU-HUYLHTAVSA-N |
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