DFF45/35, HUMAN, N-TERM_化学云数据库

DFF45/35, HUMAN, N-TERM

基本信息
产品名称：	DFF45/35, HUMAN, N-TERM
英文同义词：	DFF45/35, HUMAN, N-TERM ; EVTGDAGVPESGEIRTLKPC
MDL号：	MFCD03844528
氢键受体数量：	56
氢键供体数量：	30
Smile：	CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CS)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]2CCCN2C(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCC(=O)O)N
InChi：	InChI=1S/C86H144N24O32S/c1-12-42(8)66(81(137)99-47(19-15-29-91-86(89)90)73(129)107-68(45(11)113)82(138)101-51(32-39(2)3)76(132)100-50(18-13-14-28-87)83(139)109-30-16-20-55(109)78(134)103-54(38-143)85(141)142)106-74(130)48(23-26-61(119)120)96-57(114)34-93-71(127)53(37-111)102-72(128)49(24-27-62(121)122)98-77(133)56-21-17-31-110(56)84(140)65(41(6)7)104-59(116)36-92-69(125)43(9)95-75(131)52(33-63(123)124)97-58(115)35-94-79(135)67(44(10)112)108-80(136)64(40(4)5)105-70(126)46(88)22-25-60(117)118/h39-56,64-68,111-113,143H,12-38,87-88H2,1-11H3,(H,92,125)(H,93,127)(H,94,135)(H,95,131)(H,96,114)(H,97,115)(H,98,133)(H,99,137)(H,100,132)(H,101,138)(H,102,128)(H,103,134)(H,104,116)(H,105,126)(H,106,130)(H,107,129)(H,108,136)(H,117,118)(H,119,120)(H,121,122)(H,123,124)(H,141,142)(H4,89,90,91)/t42-,43-,44+,45+,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,64-,65-,66-,67-,68-/m0/s1
InChiKey：	InChIKey=SVYLBDMHXPEJRL-MRBMGOKRSA-N

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