基本信息 |
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| 产品名称： | PROTEIN KINASE CETA PSEUDOSUBSTRATE TRIFLUOROACETATE SALT |
| 英文同义词： | PROTEIN KINASE CETA PSEUDOSUBSTRATE TRIFLUOROACETATE SALT ; THR-ARG-LYS-ARG-GLN-ARG-ALA-MET-ARG-ARG-ARG-VAL-HIS-GLN-ILE-ASN-GLY TRIFLUOROACETATE SALT |
| MDL号： | MFCD03787992 |
| 氢键受体数量： | 63 |
| 氢键供体数量： | 42 |
| Smile： | CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(=O)N)C(=O)NCC(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H]([C@@H](C)O)N.C(=O)(C(F)(F)F)O |
| InChi： | InChI=1S/C87H159N41O22S.C2HF3O2/c1-8-43(4)65(81(150)126-58(38-61(91)132)67(136)112-40-62(133)134)128-77(146)55(25-27-60(90)131)123-78(147)57(37-46-39-105-41-113-46)125-80(149)64(42(2)3)127-76(145)53(23-16-35-111-87(103)104)121-71(140)49(19-12-31-107-83(95)96)119-70(139)50(20-13-32-108-84(97)98)120-75(144)56(28-36-151-7)115-66(135)44(5)114-68(137)48(18-11-30-106-82(93)94)117-74(143)54(24-26-59(89)130)122-72(141)51(21-14-33-109-85(99)100)118-69(138)47(17-9-10-29-88)116-73(142)52(22-15-34-110-86(101)102)124-79(148)63(92)45(6)129;3-2(4,5)1(6)7/h39,41-45,47-58,63-65,129H,8-38,40,88,92H2,1-7H3,(H2,89,130)(H2,90,131)(H2,91,132)(H,105,113)(H,112,136)(H,114,137)(H,115,135)(H,116,142)(H,117,143)(H,118,138)(H,119,139)(H,120,144)(H,121,140)(H,122,141)(H,123,147)(H,124,148)(H,125,149)(H,126,150)(H,127,145)(H,128,146)(H,133,134)(H4,93,94,106)(H4,95,96,107)(H4,97,98,108)(H4,99,100,109)(H4,101,102,110)(H4,103,104,111);(H,6,7)/t43-,44-,45+,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,63-,64-,65-;/m0./s1 |
| InChiKey： | InChIKey=AUAREJWIQJQXQD-MTZYDZCPSA-N |
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