PEP 4AK_化学云数据库

PEP 4AK

基本信息
产品名称：	PEP 4AK
英文同义词：	(LYS)(LYS)(LYS)(GLY)(SER)(VAL)(VAL)(ILE)(VAL)(GLY)(ARG)(ILE)(ILE)(LEU)(SER)(GLY)(ARG)-NH2 ; H-LYS-LYS-LYS-GLY-SER-VAL-VAL-ILE-VAL-GLY-ARG-ILE-ILE-LEU-SER-GLY-ARG-NH2 ; KKKGSVVIVGRIILSGR-NH2 ; PEP 4AK
MDL号：	MFCD02094688
氢键受体数量：	46
氢键供体数量：	29
Smile：	CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)N
InChi：	InChI=1S/C81H153N27O19/c1-15-46(12)63(77(125)101-54(36-42(4)5)72(120)102-55(40-109)69(117)94-37-57(111)96-50(66(86)114)29-24-34-91-80(87)88)108-79(127)64(47(13)16-2)106-71(119)52(30-25-35-92-81(89)90)97-58(112)39-95-74(122)60(43(6)7)104-78(126)65(48(14)17-3)107-76(124)62(45(10)11)105-75(123)61(44(8)9)103-73(121)56(41-110)98-59(113)38-93-68(116)51(27-19-22-32-83)100-70(118)53(28-20-23-33-84)99-67(115)49(85)26-18-21-31-82/h42-56,60-65,109-110H,15-41,82-85H2,1-14H3,(H2,86,114)(H,93,116)(H,94,117)(H,95,122)(H,96,111)(H,97,112)(H,98,113)(H,99,115)(H,100,118)(H,101,125)(H,102,120)(H,103,121)(H,104,126)(H,105,123)(H,106,119)(H,107,124)(H,108,127)(H4,87,88,91)(H4,89,90,92)/t46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,60-,61-,62-,63-,64-,65-/m0/s1
InChiKey：	InChIKey=YXUAXQWUCLMIBC-WKIWVYGSSA-N

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