GP120-W61D-26

CAS号
CCD编号
CCD00416133
分子式
C79 H120 N20 O28 S
分子量
1829.99

基本信息

产品名称: GP120-W61D-26
英文同义词: H-ASP-GLN-MET-HIS-GLU-ASP-ILE-ILE-SER-LEU-TRP-ASP-GLN-SER-LEU-OH ; GP120-W61D-26 ; DQMHEDIISLWDQSL
MDL号: MFCD03790063
氢键受体数量: 48
氢键供体数量: 26
Smile: CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc3c[nH]cn3)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(=O)O)N
InChi: InChI=1S/C79H120N20O28S/c1-10-38(7)63(99-78(125)64(39(8)11-2)98-74(121)53(30-62(110)111)93-67(114)47(18-21-59(104)105)88-72(119)51(27-41-32-83-35-85-41)92-69(116)48(22-23-128-9)89-66(113)45(16-19-57(81)102)86-65(112)43(80)28-60(106)107)77(124)97-56(34-101)75(122)90-49(24-36(3)4)70(117)91-50(26-40-31-84-44-15-13-12-14-42(40)44)71(118)94-52(29-61(108)109)73(120)87-46(17-20-58(82)103)68(115)96-55(33-100)76(123)95-54(79(126)127)25-37(5)6/h12-15,31-32,35-39,43,45-56,63-64,84,100-101H,10-11,16-30,33-34,80H2,1-9H3,(H2,81,102)(H2,82,103)(H,83,85)(H,86,112)(H,87,120)(H,88,119)(H,89,113)(H,90,122)(H,91,117)(H,92,116)(H,93,114)(H,94,118)(H,95,123)(H,96,115)(H,97,124)(H,98,121)(H,99,125)(H,104,105)(H,106,107)(H,108,109)(H,110,111)(H,126,127)/t38-,39-,43-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,63-,64-/m0/s1
InChiKey: InChIKey=VQQWZJWPGMBJIA-MDWIDPQGSA-N

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