basic_info |
|
| Product_Name： | BETA-AMYLOID (1-15)-LYS(BIOTIN)-NH2 |
| EnglishSynonyms： | D A E F R H D S G Y E V H H Q K (BIOTIN) NH2 ; BETA-AMYLOID (1-15)-LYS(BIOTIN)-NH2 |
| pro_mdlNumber： | MFCD22125303 |
| pro_acceptors： | 63 |
| pro_donors： | 35 |
| pro_smile： | CC(C)[C@@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCCNC(=O)CCCCCNC(=O)CCCCCNC(=O)CCCC[C@H]3[C@@H]4[C@H](CS3)NC(=O)N4)C(=O)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc5ccc(cc5)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc6c[nH]cn6)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc7ccccc7)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)N |
| InChi： | InChI=1S/C106H156N32O31S/c1-56(2)88(104(168)134-74(44-62-49-114-55-122-62)102(166)132-72(42-60-47-112-53-120-60)100(164)128-67(30-33-79(108)141)95(159)125-65(90(109)154)20-13-16-38-117-81(143)24-10-6-14-36-115-80(142)23-9-5-15-37-116-82(144)25-12-11-22-78-89-77(52-170-78)136-106(169)138-89)137-97(161)69(32-35-85(148)149)129-98(162)70(41-59-26-28-63(140)29-27-59)124-83(145)50-119-93(157)76(51-139)135-103(167)75(46-87(152)153)133-101(165)73(43-61-48-113-54-121-61)131-94(158)66(21-17-39-118-105(110)111)127-99(163)71(40-58-18-7-4-8-19-58)130-96(160)68(31-34-84(146)147)126-91(155)57(3)123-92(156)64(107)45-86(150)151/h4,7-8,18-19,26-29,47-49,53-57,64-78,88-89,139-140H,5-6,9-17,20-25,30-46,50-52,107H2,1-3H3,(H2,108,141)(H2,109,154)(H,112,120)(H,113,121)(H,114,122)(H,115,142)(H,116,144)(H,117,143)(H,119,157)(H,123,156)(H,124,145)(H,125,159)(H,126,155)(H,127,163)(H,128,164)(H,129,162)(H,130,160)(H,131,158)(H,132,166)(H,133,165)(H,134,168)(H,135,167)(H,137,161)(H,146,147)(H,148,149)(H,150,151)(H,152,153)(H4,110,111,118)(H2,136,138,169)/t57-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,88-,89-/m0/s1 |
| InChiKey： | InChIKey=UFKBLQNHBQNHQY-KHTLPWHESA-N |
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