GP120-W61D-37_化学云数据库

GP120-W61D-37

基本信息
产品名称：	GP120-W61D-37
英文同义词：	GP120-W61D-37 ; GWTGEIRKGEIKNCF ; H-GLY-TRP-THR-GLY-GLU-ILE-ARG-LYS-GLY-GLU-ILE-LYS-ASN-CYS-PHE-OH
MDL号：	MFCD03790074
氢键受体数量：	44
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](CC(=O)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2c[nH]c3c2cccc3)NC(=O)CN
InChi：	InChI=1S/C77H120N22O22S/c1-6-40(3)62(74(118)92-48(23-14-16-30-79)67(111)94-53(34-56(81)101)70(114)96-55(39-122)72(116)95-54(76(120)121)32-43-18-9-8-10-19-43)97-68(112)50(25-27-60(105)106)88-58(103)37-86-65(109)47(22-13-15-29-78)91-66(110)49(24-17-31-84-77(82)83)93-75(119)63(41(4)7-2)98-69(113)51(26-28-61(107)108)89-59(104)38-87-73(117)64(42(5)100)99-71(115)52(90-57(102)35-80)33-44-36-85-46-21-12-11-20-45(44)46/h8-12,18-21,36,40-42,47-55,62-64,85,100,122H,6-7,13-17,22-35,37-39,78-80H2,1-5H3,(H2,81,101)(H,86,109)(H,87,117)(H,88,103)(H,89,104)(H,90,102)(H,91,110)(H,92,118)(H,93,119)(H,94,111)(H,95,116)(H,96,114)(H,97,112)(H,98,113)(H,99,115)(H,105,106)(H,107,108)(H,120,121)(H4,82,83,84)/t40-,41-,42+,47-,48-,49-,50-,51-,52-,53-,54-,55-,62-,63-,64-/m0/s1
InChiKey：	InChIKey=TWENTCCBKFZFDO-ZTQKZTJMSA-N

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