basic_info |
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| Product_Name： | BETA-AMYLOID (13-29)-GLY-CYS |
| EnglishSynonyms： | BETA-AMYLOID (13-29)-GLY-CYS ; HHQKLVFFAEDVGSNKGGC ; [GLY30, CYS31] BETA-AMYLOID (13-31) ; H-HIS-HIS-GLN-LYS-LEU-VAL-PHE-PHE-ALA-GLU-ASP-VAL-GLY-SER-ASN-LYS-GLY-GLY-CYS-OH |
| pro_mdlNumber： | MFCD09264996 |
| pro_acceptors： | 54 |
| pro_donors： | 29 |
| pro_smile： | CC(C)C[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](CS)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](Cc4c[nH]cn4)N |
| InChi： | InChI=1S/C91H137N27O27S/c1-46(2)30-59(112-79(132)56(23-15-17-29-93)109-80(133)57(24-26-67(95)120)110-84(137)62(34-53-38-98-45-103-53)111-77(130)54(94)33-52-37-97-44-102-52)86(139)118-75(48(5)6)90(143)116-61(32-51-20-12-9-13-21-51)83(136)113-60(31-50-18-10-8-11-19-50)82(135)104-49(7)76(129)107-58(25-27-72(125)126)81(134)115-64(36-73(127)128)87(140)117-74(47(3)4)89(142)101-41-71(124)105-65(42-119)88(141)114-63(35-68(96)121)85(138)108-55(22-14-16-28-92)78(131)100-39-69(122)99-40-70(123)106-66(43-146)91(144)145/h8-13,18-21,37-38,44-49,54-66,74-75,119,146H,14-17,22-36,39-43,92-94H2,1-7H3,(H2,95,120)(H2,96,121)(H,97,102)(H,98,103)(H,99,122)(H,100,131)(H,101,142)(H,104,135)(H,105,124)(H,106,123)(H,107,129)(H,108,138)(H,109,133)(H,110,137)(H,111,130)(H,112,132)(H,113,136)(H,114,141)(H,115,134)(H,116,143)(H,117,140)(H,118,139)(H,125,126)(H,127,128)(H,144,145)/t49-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,74-,75-/m0/s1 |
| InChiKey： | InChIKey=PUGSEZVVAXYFSX-HEQCJNAYSA-N |
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