BAX BH3L63A

CAS号
CCD编号
CCD00739174
分子式
C74 H130 N22 O27 S
分子量
1792.03

基本信息

产品名称: BAX BH3L63A
英文同义词: H-LYS-LYS-LEU-SER-GLU-CYS-ALA-LYS-ARG-ILE-GLY-ASP-GLU-LEU-ASP-SER-OH ; BAX BH3L63A ; KKLSECAKRIGDELDS
MDL号: MFCD09264890
氢键受体数量: 49
氢键供体数量: 29
Smile: CC[C@H](C)[C@@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)N
InChi: InChI=1S/C74H130N22O27S/c1-8-38(6)58(72(121)82-32-53(99)84-48(30-56(104)105)68(117)88-44(20-22-54(100)101)63(112)91-46(28-36(2)3)66(115)92-49(31-57(106)107)69(118)94-51(34-98)73(122)123)96-65(114)43(19-15-27-81-74(79)80)87-61(110)41(17-10-13-25-76)85-59(108)39(7)83-71(120)52(35-124)95-64(113)45(21-23-55(102)103)89-70(119)50(33-97)93-67(116)47(29-37(4)5)90-62(111)42(18-11-14-26-77)86-60(109)40(78)16-9-12-24-75/h36-52,58,97-98,124H,8-35,75-78H2,1-7H3,(H,82,121)(H,83,120)(H,84,99)(H,85,108)(H,86,109)(H,87,110)(H,88,117)(H,89,119)(H,90,111)(H,91,112)(H,92,115)(H,93,116)(H,94,118)(H,95,113)(H,96,114)(H,100,101)(H,102,103)(H,104,105)(H,106,107)(H,122,123)(H4,79,80,81)/t38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,58-/m0/s1
InChiKey: InChIKey=KELSCYRSTBTJLQ-IJQRHQRZSA-N

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