basic_info |
|
| Product_Name： | H-ALA-PRO-SER-ASP-PRO-ARG-LEU-ARG-GLN-PHE-LEU-GLN-LYS-SER-LEU-ALA-ALA-ALA-ALA-NH2 TRIFLUOROACETATE SALT |
| EnglishSynonyms： | NEURONOSTATIN-19 (HUMAN, CANINE, PORCINE) TRIFLUOROACETATE SALT ; H-ALA-PRO-SER-ASP-PRO-ARG-LEU-ARG-GLN-PHE-LEU-GLN-LYS-SER-LEU-ALA-ALA-ALA-ALA-NH2 TRIFLUOROACETATE SALT |
| pro_mdlNumber： | MFCD18782456 |
| pro_acceptors： | 54 |
| pro_donors： | 30 |
| pro_smile： | CC(C)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H]3CCCN3C(=O)C(C)N.C(=O)(C(F)(F)F)O |
| InChi： | InChI=1S/C90H151N29O25.C2HF3O2/c1-44(2)37-58(79(135)105-51(11)73(129)104-50(10)72(128)103-49(9)71(127)102-48(8)70(95)126)113-83(139)63(42-120)116-76(132)53(23-15-16-32-91)106-77(133)56(28-30-67(93)122)109-81(137)60(39-46(5)6)112-82(138)61(40-52-21-13-12-14-22-52)114-78(134)57(29-31-68(94)123)108-74(130)54(24-17-33-100-89(96)97)107-80(136)59(38-45(3)4)111-75(131)55(25-18-34-101-90(98)99)110-85(141)66-27-20-36-119(66)88(144)62(41-69(124)125)115-84(140)64(43-121)117-86(142)65-26-19-35-118(65)87(143)47(7)92;3-2(4,5)1(6)7/h12-14,21-22,44-51,53-66,120-121H,15-20,23-43,91-92H2,1-11H3,(H2,93,122)(H2,94,123)(H2,95,126)(H,102,127)(H,103,128)(H,104,129)(H,105,135)(H,106,133)(H,107,136)(H,108,130)(H,109,137)(H,110,141)(H,111,131)(H,112,138)(H,113,139)(H,114,134)(H,115,140)(H,116,132)(H,117,142)(H,124,125)(H4,96,97,100)(H4,98,99,101);(H,6,7)/t47?,48-,49-,50-,51-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-;/m0./s1 |
| InChiKey： | InChIKey=XYSTTZWYHJOCCF-XSBASMEXSA-N |
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