GP120-W61D-86

CAS号
CCD编号
CCD00416192
分子式
C80 H134 N24 O22
分子量
1784.08

基本信息

产品名称: GP120-W61D-86
英文同义词: H-LEU-SER-ARG-ALA-GLN-TRP-ASN-ASN-THR-LEU-LYS-GLN-ILE-VAL-ILE-OH ; GP120-W61D-86 ; LSRAQWNNTLKQIVI
MDL号: MFCD03790123
氢键受体数量: 46
氢键供体数量: 27
Smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N
InChi: InChI=1S/C80H134N24O22/c1-13-40(9)62(77(123)101-61(39(7)8)76(122)103-63(79(125)126)41(10)14-2)102-70(116)51(25-27-58(84)108)95-68(114)48(22-17-18-28-81)93-71(117)52(31-38(5)6)99-78(124)64(43(12)106)104-74(120)55(34-60(86)110)98-73(119)54(33-59(85)109)97-72(118)53(32-44-35-90-47-21-16-15-20-45(44)47)96-69(115)50(24-26-57(83)107)92-65(111)42(11)91-67(113)49(23-19-29-89-80(87)88)94-75(121)56(36-105)100-66(112)46(82)30-37(3)4/h15-16,20-21,35,37-43,46,48-56,61-64,90,105-106H,13-14,17-19,22-34,36,81-82H2,1-12H3,(H2,83,107)(H2,84,108)(H2,85,109)(H2,86,110)(H,91,113)(H,92,111)(H,93,117)(H,94,121)(H,95,114)(H,96,115)(H,97,118)(H,98,119)(H,99,124)(H,100,112)(H,101,123)(H,102,116)(H,103,122)(H,104,120)(H,125,126)(H4,87,88,89)/t40-,41-,42-,43+,46-,48-,49-,50-,51-,52-,53-,54-,55-,56-,61-,62-,63-,64-/m0/s1
InChiKey: InChIKey=LWZXAMGXEBWOGU-SGTRSVGOSA-N

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