basic_info |
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Product_Name: | 山竹子素 |
CAS: | 78824-30-3 |
中文同义词: | 山竹子素 |
EnglishSynonyms: | 3-(3,4-DIHYDROXYBENZOYL)-4-HYDROXY-8,8-DIMETHYL-1,7-BIS(3-METHYL-2-BUTEN-1-YL)-5-[(2S)-5-METHYL-2-(1-METHYLETHENYL)-4-HEXEN-1-YL]-BICYCLO[3.3.1]NON-3-ENE-2,9-DIONE ; CAMBOGINOL ; GARCINOL ; (1R,5R,7R)-3-(3,4-DIHYDROXYBENZOYL)-4-HYDROXY-8,8-DIMETHYL-1,7-BIS(3-METHYL-2-BUTEN-1-YL)-5-[(2S)-5-METHYL-2-(1-METHYLETHENYL)-4-HEXEN-1-YL]-BICYCLO[3.3.1]NON-3-ENE-2,9-DIONE |
pro_mdlNumber: | MFCD03700761 |
pro_acceptors: | 6 |
pro_donors: | 3 |
pro_smile: | CC(=CC[C@@H]1C[C@@]2(C(=C(C(=O)[C@@](C2=O)(C1(C)C)CC=C(C)C)C(=O)c3ccc(c(c3)O)O)O)C[C@H](CC=C(C)C)C(=C)C)C |
InChi: | InChI=1S/C38H50O6/c1-22(2)11-13-27(25(7)8)20-37-21-28(15-12-23(3)4)36(9,10)38(35(37)44,18-17-24(5)6)34(43)31(33(37)42)32(41)26-14-16-29(39)30(40)19-26/h11-12,14,16-17,19,27-28,39-40,42H,7,13,15,18,20-21H2,1-6,8-10H3/t27-,28+,37+,38-/m0/s1 |
InChiKey: | InChIKey=QDKLRKZQSOQWJQ-SMDXAGPFSA-N |
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