basic_info |
|
| Product_Name: | GAG P1 (9-16) / P6 (1-9) |
| EnglishSynonyms: | P15 (441-457) ; TYR-LYS-GLY-ARG-PRO-GLY-ASN-PHE-LEU-GLN-SER-ARG-PRO-GLU-PRO-THR-ALA ; GAG P1 (9-16) / P6 (1-9) |
| pro_mdlNumber: | MFCD00273620 |
| pro_acceptors: | 51 |
| pro_donors: | 28 |
| pro_smile: | CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N2CCC[C@H]2C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](CC(=O)N)NC(=O)CNC(=O)[C@@H]4CCCN4C(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc5ccc(cc5)O)N |
| InChi: | InChI=1S/C85H132N26O25/c1-44(2)37-56(72(124)102-52(27-29-63(88)115)71(123)107-59(43-112)75(127)103-54(19-11-33-95-85(92)93)81(133)110-35-13-21-61(110)77(129)104-55(28-30-67(119)120)82(134)111-36-14-22-62(111)78(130)108-68(46(4)113)79(131)98-45(3)83(135)136)105-73(125)57(39-47-15-6-5-7-16-47)106-74(126)58(40-64(89)116)100-66(118)42-97-76(128)60-20-12-34-109(60)80(132)53(18-10-32-94-84(90)91)99-65(117)41-96-70(122)51(17-8-9-31-86)101-69(121)50(87)38-48-23-25-49(114)26-24-48/h5-7,15-16,23-26,44-46,50-62,68,112-114H,8-14,17-22,27-43,86-87H2,1-4H3,(H2,88,115)(H2,89,116)(H,96,122)(H,97,128)(H,98,131)(H,99,117)(H,100,118)(H,101,121)(H,102,124)(H,103,127)(H,104,129)(H,105,125)(H,106,126)(H,107,123)(H,108,130)(H,119,120)(H,135,136)(H4,90,91,94)(H4,92,93,95)/t45-,46+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,68-/m0/s1 |
| InChiKey: | InChIKey=PXILFOJLDDYLEG-HKJHSXJASA-N |
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