basic_info |
|
| Product_Name: | ASP-MET-HIS-ASP-PHE-PHE-VAL-GLY-LEU-MET-NH2 1/2 ACOH 4H2O |
| EnglishSynonyms: | NEUROMEDIN K (HUMAN, PORCINE, BOVINE, RAT, MOUSE) 1/2 ACOH 4H2O ; NEUROKININ B (HUMAN, PORCINE, BOVINE, RAT, MOUSE) 1/2 ACOH 4H2O ; ASP-MET-HIS-ASP-PHE-PHE-VAL-GLY-LEU-MET-NH2 1/2 ACOH 4H2O |
| pro_mdlNumber: | MFCD00797530 |
| pro_acceptors: | 27 |
| pro_donors: | 14 |
| pro_smile: | O.O.O.O.O.CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC1=CNC=N1)NC(=O)[C@H](CCSC)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(N)=O |
| InChi: | InChI=1S/C55H79N13O14S2.5H2O/c1-30(2)21-38(50(77)62-36(47(57)74)17-19-83-5)61-43(69)28-59-55(82)46(31(3)4)68-54(81)40(23-33-15-11-8-12-16-33)65-51(78)39(22-32-13-9-7-10-14-32)64-53(80)42(26-45(72)73)67-52(79)41(24-34-27-58-29-60-34)66-49(76)37(18-20-84-6)63-48(75)35(56)25-44(70)71;;;;;/h7-16,27,29-31,35-42,46H,17-26,28,56H2,1-6H3,(H2,57,74)(H,58,60)(H,59,82)(H,61,69)(H,62,77)(H,63,75)(H,64,80)(H,65,78)(H,66,76)(H,67,79)(H,68,81)(H,70,71)(H,72,73);5*1H2/t35-,36-,37-,38-,39-,40-,41-,42-,46-;;;;;/m0...../s1 |
| InChiKey: | InChIKey=WKMYJNUQLZJYHT-LLZWZCKZSA-N |
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