ALPHA-GLIADIN (57-73)_ChemCD

ALPHA-GLIADIN (57-73)

basic_info
Product_Name：	ALPHA-GLIADIN (57-73)
EnglishSynonyms：	QLQPFPQPELPYPQPQS ; ALPHA-GLIADIN (57-73) ; H-GLN-LEU-GLN-PRO-PHE-PRO-GLN-PRO-GLU-LEU-PRO-TYR-PRO-GLN-PRO-GLN-SER-OH
pro_mdlNumber：	MFCD09753346
pro_acceptors：	49
pro_donors：	20
pro_smile：	CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc2ccccc2)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CCC(=O)N)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N5CCC[C@H]5C(=O)N[C@@H](Cc6ccc(cc6)O)C(=O)N7CCC[C@H]7C(=O)N[C@@H](CCC(=O)N)C(=O)N8CCC[C@H]8C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCC(=O)N)N
InChi：	InChI=1S/C93H136N22O27/c1-49(2)44-60(105-77(125)54(94)26-32-71(95)118)80(128)102-57(28-34-73(97)120)87(135)112-40-10-20-69(112)85(133)107-62(46-51-14-6-5-7-15-51)91(139)114-42-11-18-67(114)83(131)103-59(30-36-75(99)122)89(137)111-39-9-17-66(111)82(130)101-56(31-37-76(123)124)78(126)106-61(45-50(3)4)90(138)113-41-13-21-70(113)86(134)108-63(47-52-22-24-53(117)25-23-52)92(140)115-43-12-19-68(115)84(132)104-58(29-35-74(98)121)88(136)110-38-8-16-65(110)81(129)100-55(27-33-72(96)119)79(127)109-64(48-116)93(141)142/h5-7,14-15,22-25,49-50,54-70,116-117H,8-13,16-21,26-48,94H2,1-4H3,(H2,95,118)(H2,96,119)(H2,97,120)(H2,98,121)(H2,99,122)(H,100,129)(H,101,130)(H,102,128)(H,103,131)(H,104,132)(H,105,125)(H,106,126)(H,107,133)(H,108,134)(H,109,127)(H,123,124)(H,141,142)/t54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-/m0/s1
InChiKey：	InChIKey=KTESPYHWHKBNIS-IXQHNDDQSA-N

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