ALPHA-SECRETASE SUBSTRATE-1_化学云数据库

ALPHA-SECRETASE SUBSTRATE-1

基本信息
产品名称：	ALPHA-SECRETASE SUBSTRATE-1
英文同义词：	MCA-YEVHHQKVFK(DNP)-NH2 ; ALPHA-SECRETASE SUBSTRATE-1
MDL号：	MFCD07366977
氢键受体数量：	42
氢键供体数量：	18
Smile：	CC(C)[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCNc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])C(=O)N)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)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc5ccc(cc5)O)NC(=O)Cc6cc(=O)oc7c6ccc(c7)OC
InChi：	InChI=1S/C80H102N20O22/c1-43(2)69(79(115)95-60(31-45-13-7-6-8-14-45)76(112)90-55(71(83)107)15-10-12-30-86-54-24-19-50(99(117)118)37-63(54)100(119)120)97-73(109)56(16-9-11-29-81)91-72(108)57(25-27-65(82)102)92-77(113)61(35-48-39-84-41-87-48)94-78(114)62(36-49-40-85-42-88-49)96-80(116)70(44(3)4)98-74(110)58(26-28-67(104)105)93-75(111)59(32-46-17-20-51(101)21-18-46)89-66(103)33-47-34-68(106)122-64-38-52(121-5)22-23-53(47)64/h6-8,13-14,17-24,34,37-44,55-62,69-70,86,101H,9-12,15-16,25-33,35-36,81H2,1-5H3,(H2,82,102)(H2,83,107)(H,84,87)(H,85,88)(H,89,103)(H,90,112)(H,91,108)(H,92,113)(H,93,111)(H,94,114)(H,95,115)(H,96,116)(H,97,109)(H,98,110)(H,104,105)/t55-,56-,57-,58-,59-,60-,61-,62-,69-,70-/m0/s1
InChiKey：	InChIKey=NBVRUDROOQIQFW-TYJQANSVSA-N

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