basic_info |
|
Product_Name: | MRDNWRSELYKYKVV |
EnglishSynonyms: | H-MET-ARG-ASP-ASN-TRP-ARG-SER-GLU-LEU-TYR-LYS-TYR-LYS-VAL-VAL-OH ; MRDNWRSELYKYKVV ; GP120-W61D-121 ; HIV-1 MN ENV-120 |
pro_mdlNumber: | MFCD03790158 |
pro_acceptors: | 49 |
pro_donors: | 31 |
pro_smile: | CC(C)C[C@@H](C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2ccc(cc2)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc3c[nH]c4c3cccc4)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)N |
InChi: | InChI=1S/C90H139N25O24S/c1-46(2)38-62(80(130)109-64(40-50-24-28-53(118)29-25-50)82(132)103-57(18-10-12-33-91)75(125)108-63(39-49-22-26-52(117)27-23-49)81(131)104-58(19-11-13-34-92)79(129)114-72(47(3)4)87(137)115-73(48(5)6)88(138)139)107-78(128)61(30-31-70(120)121)106-86(136)68(45-116)113-77(127)60(21-15-36-100-90(97)98)105-83(133)65(41-51-44-101-56-17-9-8-16-54(51)56)110-84(134)66(42-69(94)119)111-85(135)67(43-71(122)123)112-76(126)59(20-14-35-99-89(95)96)102-74(124)55(93)32-37-140-7/h8-9,16-17,22-29,44,46-48,55,57-68,72-73,101,116-118H,10-15,18-21,30-43,45,91-93H2,1-7H3,(H2,94,119)(H,102,124)(H,103,132)(H,104,131)(H,105,133)(H,106,136)(H,107,128)(H,108,125)(H,109,130)(H,110,134)(H,111,135)(H,112,126)(H,113,127)(H,114,129)(H,115,137)(H,120,121)(H,122,123)(H,138,139)(H4,95,96,99)(H4,97,98,100)/t55-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,72-,73-/m0/s1 |
InChiKey: | InChIKey=DYFBASXGTDOHJU-OCBRLLHXSA-N |
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