basic_info |
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| Product_Name: | 商陆皂甙丁 |
| CAS: | 89808-50-4 |
| 中文同义词: | 商陆皂甙丁 |
| EnglishSynonyms: | (2S,4AR,6AR,6AS,6BR,8AR,9R,10R,11S,12AR,14BS)-11-HYDROXY-9-(HYDROXYMETHYL)-2-METHOXYCARBONYL-2,6A,6B,9,12A-PENTAMETHYL-10-[(2R,3R,4S ; ESCULENTOSIDE D |
| pro_mdlNumber: | MFCD11111465 |
| pro_acceptors: | 12 |
| pro_donors: | 7 |
| pro_smile: | C[C@@]1(CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(C[C@@H]([C@@H]([C@@]5(C)CO)O[C@@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)C)C)[C@@H]2C1)C)C(=O)O)C(=O)OC |
| InChi: | InChI=1S/C37H58O12/c1-32(31(46)47-6)11-13-37(30(44)45)14-12-35(4)19(20(37)15-32)7-8-24-33(2)16-21(40)28(34(3,18-39)23(33)9-10-36(24,35)5)49-29-27(43)26(42)25(41)22(17-38)48-29/h7,20-29,38-43H,8-18H2,1-6H3,(H,44,45)/t20-,21-,22+,23+,24+,25+,26-,27+,28-,29+,32-,33-,34-,35+,36+,37-/m0/s1 |
| InChiKey: | InChIKey=OHDFISPWADYJIW-OUYKRPPKSA-N |
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