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基本信息 |
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产品名称: | 2-((2S,3S)-4-((E)-3-((R)-1-CARBOXY-2-(3,4-DIHYDROXYPHENYL)ETHOXY)-3-OXOPROP-1-ENYL)-2-(3,4-DIHYDROXYPHENYL)-7-HYDROXY-2,3-DIHYDROBENZOFURAN-3-CARBONYLOXY)-3-(3,4-DIHYDROXYPHENYL)PROPANOIC ACID |
CAS: | 115939-25-8 |
英文同义词: | SALVIANOLIC?ACID?B ; 2-((2S,3S)-4-((E)-3-((R)-1-CARBOXY-2-(3,4-DIHYDROXYPHENYL)ETHOXY)-3-OXOPROP-1-ENYL)-2-(3,4-DIHYDROXYPHENYL)-7-HYDROXY-2,3-DIHYDROBENZOFURAN-3-CARBONYLOXY)-3-(3,4-DIHYDROXYPHENYL)PROPANOIC ACID |
MDL号: | MFCD22125310 |
氢键受体数量: | 16 |
氢键供体数量: | 9 |
Smile: | c1cc(c(cc1C[C@H](C(=O)O)OC(=O)/C=C/c2ccc(c3c2[C@@H]([C@H](O3)c4ccc(c(c4)O)O)C(=O)OC(Cc5ccc(c(c5)O)O)C(=O)O)O)O)O |
InChi: | InChI=1S/C36H30O16/c37-20-6-1-16(11-24(20)41)13-27(34(45)46)50-29(44)10-5-18-3-9-23(40)33-30(18)31(32(52-33)19-4-8-22(39)26(43)15-19)36(49)51-28(35(47)48)14-17-2-7-21(38)25(42)12-17/h1-12,15,27-28,31-32,37-43H,13-14H2,(H,45,46)(H,47,48)/b10-5+/t27-,28?,31+,32-/m1/s1 |
InChiKey: | InChIKey=SNKFFCBZYFGCQN-ARBMFGAVSA-N |
* If the product has intellectual property rights, a license granted is must or contact us.