basic_info |
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Product_Name: | APOLIPOPROTEIN B-100 (3136-3155), HUMAN |
EnglishSynonyms: | APOLIPOPROTEIN B-100 (3136-3155), HUMAN ; KTTKQSFDLSVKAQYKKNKH |
pro_mdlNumber: | MFCD18251972 |
pro_acceptors: | 62 |
pro_donors: | 37 |
pro_smile: | CC(C)C[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCCN)N |
InChi: | InChI=1S/C106H175N31O31/c1-55(2)45-72(127-100(161)76(50-83(146)147)131-98(159)73(46-60-23-9-8-10-24-60)129-101(162)78(52-138)133-95(156)71(36-38-81(115)144)124-91(152)69(30-16-22-44-112)126-104(165)85(58(6)140)137-105(166)86(59(7)141)136-88(149)64(113)25-11-17-39-107)96(157)134-79(53-139)102(163)135-84(56(3)4)103(164)125-65(26-12-18-40-108)89(150)119-57(5)87(148)120-70(35-37-80(114)143)94(155)128-74(47-61-31-33-63(142)34-32-61)97(158)122-66(27-13-19-41-109)90(151)121-67(28-14-20-42-110)92(153)130-75(49-82(116)145)99(160)123-68(29-15-21-43-111)93(154)132-77(106(167)168)48-62-51-117-54-118-62/h8-10,23-24,31-34,51,54-59,64-79,84-86,138-142H,11-22,25-30,35-50,52-53,107-113H2,1-7H3,(H2,114,143)(H2,115,144)(H2,116,145)(H,117,118)(H,119,150)(H,120,148)(H,121,151)(H,122,158)(H,123,160)(H,124,152)(H,125,164)(H,126,165)(H,127,161)(H,128,155)(H,129,162)(H,130,153)(H,131,159)(H,132,154)(H,133,156)(H,134,157)(H,135,163)(H,136,149)(H,137,166)(H,146,147)(H,167,168)/t57-,58+,59+,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,84-,85-,86-/m0/s1 |
InChiKey: | InChIKey=DVFKYKUBKGKNFO-WDOKSKLGSA-N |
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