AETPTYPWRDAETGERC_化学云数据库

AETPTYPWRDAETGERC

基本信息
产品名称：	AETPTYPWRDAETGERC
英文同义词：	DCR3, HUMAN, N-TERM ; AETPTYPWRDAETGERC
MDL号：	MFCD03844565
氢键受体数量：	54
氢键供体数量：	31
Smile：	C[C@H]([C@@H](C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc3c[nH]c4c3cccc4)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)O)NC(=O)[C@@H]5CCCN5C(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)N)O
InChi：	InChI=1S/C84H124N24O30S/c1-38(85)67(122)96-51(23-26-61(116)117)73(128)106-66(42(5)111)81(136)108-31-11-17-58(108)77(132)105-65(41(4)110)79(134)102-55(32-43-18-20-45(112)21-19-43)80(135)107-30-10-16-57(107)76(131)101-53(33-44-35-92-47-13-7-6-12-46(44)47)75(130)99-48(14-8-28-90-83(86)87)69(124)100-54(34-63(120)121)74(129)94-39(2)68(123)97-52(24-27-62(118)119)72(127)104-64(40(3)109)78(133)93-36-59(113)95-50(22-25-60(114)115)71(126)98-49(15-9-29-91-84(88)89)70(125)103-56(37-139)82(137)138/h6-7,12-13,18-21,35,38-42,48-58,64-66,92,109-112,139H,8-11,14-17,22-34,36-37,85H2,1-5H3,(H,93,133)(H,94,129)(H,95,113)(H,96,122)(H,97,123)(H,98,126)(H,99,130)(H,100,124)(H,101,131)(H,102,134)(H,103,125)(H,104,127)(H,105,132)(H,106,128)(H,114,115)(H,116,117)(H,118,119)(H,120,121)(H,137,138)(H4,86,87,90)(H4,88,89,91)/t38-,39-,40+,41+,42+,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,64-,65-,66-/m0/s1
InChiKey：	InChIKey=RDOIOELUBWMZRN-MUWCWWBDSA-N

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