basic_info |
|
| Product_Name: | 仙鹤草酚B |
| CAS: | 55576-66-4 |
| 中文同义词: | 仙鹤草酚B |
| EnglishSynonyms: | AGRIMOL B |
| pro_mdlNumber: | MFCD20527284 |
| pro_acceptors: | 12 |
| pro_donors: | 7 |
| pro_smile: | CCCC(=O)c1c(c(c(c(c1OC)C)O)Cc2c(c(c(c(c2O)C(=O)[C@@H](C)CC)O)Cc3c(c(c(c(c3O)C(=O)CCC)OC)C)O)O)O |
| InChi: | InChI=1S/C37H46O12/c1-9-12-23(38)25-32(44)19(29(41)17(5)36(25)48-7)14-21-31(43)22(35(47)27(34(21)46)28(40)16(4)11-3)15-20-30(42)18(6)37(49-8)26(33(20)45)24(39)13-10-2/h16,41-47H,9-15H2,1-8H3/t16-/m0/s1 |
| InChiKey: | InChIKey=BVLHMPZMQVWDGX-INIZCTEOSA-N |
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