basic_info |
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Product_Name: | 阿法拉新 |
CAS: | 60173-73-1 |
中文同义词: | 阿法拉新 ; 尔法来星 |
EnglishSynonyms: | ARFALASIN |
pro_mdlNumber: | MFCD00868597 |
pro_acceptors: | 24 |
pro_donors: | 13 |
pro_smile: | CC(C)[C@@H](C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N3CCC[C@H]3C(=O)NC(c4ccccc4)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CCC(=O)N |
InChi: | InChI=1S/C48H67N13O11/c1-26(2)38(58-41(65)32(12-8-20-53-48(50)51)55-37(64)19-18-36(49)63)44(68)56-33(22-28-14-16-31(62)17-15-28)42(66)59-39(27(3)4)45(69)57-34(23-30-24-52-25-54-30)46(70)61-21-9-13-35(61)43(67)60-40(47(71)72)29-10-6-5-7-11-29/h5-7,10-11,14-17,24-27,32-35,38-40,62H,8-9,12-13,18-23H2,1-4H3,(H2,49,63)(H,52,54)(H,55,64)(H,56,68)(H,57,69)(H,58,65)(H,59,66)(H,60,67)(H,71,72)(H4,50,51,53)/t32-,33-,34-,35-,38-,39-,40?/m0/s1 |
InChiKey: | InChIKey=IBGNPQRJAXAGJH-RKRIGHNJSA-N |
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