GP120-W61D-80

CAS号
CCD编号
CCD00416186
分子式
C78 H124 N24 O17
分子量
1669.99

基本信息

产品名称: GP120-W61D-80
英文同义词: HIGPGRAFYAARKII ; GP120-W61D-80 ; H-HIS-ILE-GLY-PRO-GLY-ARG-ALA-PHE-TYR-ALA-ALA-ARG-LYS-ILE-ILE-OH
MDL号: MFCD03790117
氢键受体数量: 41
氢键供体数量: 24
Smile: CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@@H]3CCCN3C(=O)CNC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](Cc4c[nH]cn4)N
InChi: InChI=1S/C78H124N24O17/c1-10-42(4)61(99-67(109)52(80)37-50-38-85-41-90-50)74(116)89-40-60(105)102-34-20-26-58(102)73(115)88-39-59(104)94-53(24-18-32-86-77(81)82)68(110)92-47(9)66(108)97-57(35-48-21-14-13-15-22-48)72(114)98-56(36-49-27-29-51(103)30-28-49)71(113)93-45(7)64(106)91-46(8)65(107)95-55(25-19-33-87-78(83)84)69(111)96-54(23-16-17-31-79)70(112)100-62(43(5)11-2)75(117)101-63(76(118)119)44(6)12-3/h13-15,21-22,27-30,38,41-47,52-58,61-63,103H,10-12,16-20,23-26,31-37,39-40,79-80H2,1-9H3,(H,85,90)(H,88,115)(H,89,116)(H,91,106)(H,92,110)(H,93,113)(H,94,104)(H,95,107)(H,96,111)(H,97,108)(H,98,114)(H,99,109)(H,100,112)(H,101,117)(H,118,119)(H4,81,82,86)(H4,83,84,87)/t42-,43-,44-,45-,46-,47-,52-,53-,54-,55-,56-,57-,58-,61-,62-,63-/m0/s1
InChiKey: InChIKey=OGVJDYOARWTXII-DVDCDCIWSA-N

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