Basic Information |
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| Product Name： | CDIP2 |
| English Synonyms： | TUMOR NECROSIS FACTOR SUPERFAMILY LIGANDS ; KISLQRLKSYVITTSRCPQ ; TNFR ; CDIP2 ; TUMOR NECROSIS FACTOR RECEPTOR ; TNF RECEPTOR LIGANDS |
| MDL Number.： | MFCD18252157 |
| H bond acceptor： | 57 |
| H bond donor： | 35 |
| Smile： | CC[C@H](C)[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCC(=O)N)C(=O)O)NC(=O)[C@H](CCCCN)N |
| InChi： | InChI=1S/C96H167N29O28S/c1-13-49(9)72(121-76(134)55(99)21-15-17-34-97)89(147)117-66(44-128)86(144)114-62(40-47(5)6)82(140)110-58(29-31-69(100)132)79(137)108-57(23-19-36-106-95(102)103)77(135)113-61(39-46(3)4)81(139)109-56(22-16-18-35-98)78(136)116-64(42-126)85(143)115-63(41-53-25-27-54(131)28-26-53)83(141)120-71(48(7)8)88(146)122-73(50(10)14-2)90(148)123-75(52(12)130)92(150)124-74(51(11)129)91(149)118-65(43-127)84(142)111-59(33-37-107-96(104)105)80(138)119-67(45-154)93(151)125-38-20-24-68(125)87(145)112-60(94(152)153)30-32-70(101)133/h25-28,46-52,55-68,71-75,126-131,154H,13-24,29-45,97-99H2,1-12H3,(H2,100,132)(H2,101,133)(H,108,137)(H,109,139)(H,110,140)(H,111,142)(H,112,145)(H,113,135)(H,114,144)(H,115,143)(H,116,136)(H,117,147)(H,118,149)(H,119,138)(H,120,141)(H,121,134)(H,122,146)(H,123,148)(H,124,150)(H,152,153)(H4,102,103,106)(H4,104,105,107)/t49-,50-,51+,52+,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,71-,72-,73-,74-,75-/m0/s1 |
| InChiKey： | InChIKey=RGHRLCSHINDDBZ-DWFFUDMUSA-N |
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