DFF45, HUMAN, C-TERM_化学云数据库

DFF45, HUMAN, C-TERM

基本信息
产品名称：	DFF45, HUMAN, C-TERM
英文同义词：	KASPPGDLQNPKRARQDPT ; DFF45, HUMAN, C-TERM
MDL号：	MFCD03844527
氢键受体数量：	59
氢键供体数量：	31
Smile：	CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)O)C(=O)N2CCC[C@H]2C(=O)N[C@@H]([C@@H](C)O)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)[C@@H]4CCCN4C(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)N
InChi：	InChI=1S/C87H146N30O29/c1-42(2)36-52(109-77(137)53(38-65(124)125)103-64(123)40-100-78(138)57-20-12-34-116(57)84(144)60-23-15-35-117(60)83(143)56(41-118)112-69(129)43(3)101-70(130)46(90)16-6-8-28-88)76(136)107-51(25-27-62(92)121)74(134)110-54(37-63(93)122)81(141)114-32-13-21-58(114)79(139)108-47(17-7-9-29-89)72(132)105-48(18-10-30-98-86(94)95)71(131)102-44(4)68(128)104-49(19-11-31-99-87(96)97)73(133)106-50(24-26-61(91)120)75(135)111-55(39-66(126)127)82(142)115-33-14-22-59(115)80(140)113-67(45(5)119)85(145)146/h42-60,67,118-119H,6-41,88-90H2,1-5H3,(H2,91,120)(H2,92,121)(H2,93,122)(H,100,138)(H,101,130)(H,102,131)(H,103,123)(H,104,128)(H,105,132)(H,106,133)(H,107,136)(H,108,139)(H,109,137)(H,110,134)(H,111,135)(H,112,129)(H,113,140)(H,124,125)(H,126,127)(H,145,146)(H4,94,95,98)(H4,96,97,99)/t43-,44-,45+,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,67-/m0/s1
InChiKey：	InChIKey=FXSPLSQLFCQWJE-WJSIZUJWSA-N

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