Pro_Molecular_Structure:
pro_cdbregno:CCD00416226
GGGDMRDNWRSELYK
pro_formula:C75 H114 N24 O25 S
pro_molWeight:1783.93
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| Product_Name： | GGGDMRDNWRSELYK |
| EnglishSynonyms： | GGGDMRDNWRSELYK ; GP120-W61D-120 ; H-GLY-GLY-GLY-ASP-MET-ARG-ASP-ASN-TRP-ARG-SER-GLU-LEU-TYR-LYS-OH ; HIV-1 MN ENV-119 |
| pro_mdlNumber： | MFCD03790157 |
| pro_acceptors： | 49 |
| pro_donors： | 30 |
| pro_smile： | CC(C)C[C@@H](C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)N[C@@H](CCCCN)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](Cc2c[nH]c3c2cccc3)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)NC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)CNC(=O)CN |
| InChi： | InChI=1S/C75H114N24O25S/c1-37(2)26-48(66(116)95-49(27-38-15-17-40(101)18-16-38)67(117)93-47(73(123)124)12-6-7-22-76)94-64(114)45(19-20-59(106)107)91-72(122)54(36-100)99-63(113)44(14-9-24-84-75(81)82)90-68(118)50(28-39-33-85-42-11-5-4-10-41(39)42)96-69(119)51(29-55(78)102)97-71(121)53(31-61(110)111)98-62(112)43(13-8-23-83-74(79)80)89-65(115)46(21-25-125-3)92-70(120)52(30-60(108)109)88-58(105)35-87-57(104)34-86-56(103)32-77/h4-5,10-11,15-18,33,37,43-54,85,100-101H,6-9,12-14,19-32,34-36,76-77H2,1-3H3,(H2,78,102)(H,86,103)(H,87,104)(H,88,105)(H,89,115)(H,90,118)(H,91,122)(H,92,120)(H,93,117)(H,94,114)(H,95,116)(H,96,119)(H,97,121)(H,98,112)(H,99,113)(H,106,107)(H,108,109)(H,110,111)(H,123,124)(H4,79,80,83)(H4,81,82,84)/t43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-/m0/s1 |
| InChiKey： | InChIKey=KHKOGDISKWGKTP-NZPOSQPQSA-N |
basic_info
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