GP120-W61D-106_化学云数据库

GP120-W61D-106

基本信息
产品名称：	GP120-W61D-106
英文同义词：	GP120-W61D-106 ; H-ARG-ILE-LYS-GLN-ILE-ILE-ASN-MET-TRP-GLN-GLU-VAL-GLY-LYS-ALA-OH ; RIKQIINMWQEVGKA
MDL号：	MFCD03790143
氢键受体数量：	45
氢键供体数量：	26
Smile：	CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)N
InChi：	InChI=1S/C81H136N24O21S/c1-11-42(6)64(103-67(112)48(84)22-20-35-90-81(88)89)77(122)99-51(25-17-19-34-83)69(114)95-53(27-30-59(86)107)73(118)104-66(44(8)13-3)79(124)105-65(43(7)12-2)78(123)101-57(38-60(87)108)75(120)98-55(32-36-127-10)71(116)100-56(37-46-39-91-49-23-15-14-21-47(46)49)74(119)97-52(26-29-58(85)106)70(115)96-54(28-31-62(110)111)72(117)102-63(41(4)5)76(121)92-40-61(109)94-50(24-16-18-33-82)68(113)93-45(9)80(125)126/h14-15,21,23,39,41-45,48,50-57,63-66,91H,11-13,16-20,22,24-38,40,82-84H2,1-10H3,(H2,85,106)(H2,86,107)(H2,87,108)(H,92,121)(H,93,113)(H,94,109)(H,95,114)(H,96,115)(H,97,119)(H,98,120)(H,99,122)(H,100,116)(H,101,123)(H,102,117)(H,103,112)(H,104,118)(H,105,124)(H,110,111)(H,125,126)(H4,88,89,90)/t42-,43-,44-,45-,48-,50-,51-,52-,53-,54-,55-,56-,57-,63-,64-,65-,66-/m0/s1
InChiKey：	InChIKey=IGQYYVLEXULUIU-FYNQUZCASA-N

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