basic_info |
|
| Product_Name： | GAG P24 CA (161-178) |
| EnglishSynonyms： | PHE-ARG-ASP-TYR-VAL-ASP-ARG-PHE-TYR-LYS-THR-LEU-ARG-ALA-GLU-GLN-ALA-SER ; P25 (293-310) ; GAG P24 CA (161-178) |
| pro_mdlNumber： | MFCD00273646 |
| pro_acceptors： | 59 |
| pro_donors： | 37 |
| pro_smile： | CC(C)C[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccc(cc1)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc3ccc(cc3)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](Cc4ccccc4)N |
| InChi： | InChI=1S/C102H153N29O30/c1-51(2)43-69(91(152)120-64(24-16-40-112-100(106)107)85(146)115-53(5)82(143)117-68(36-38-77(137)138)89(150)122-67(35-37-76(105)136)86(147)116-54(6)83(144)129-75(50-132)99(160)161)127-98(159)81(55(7)133)131-90(151)63(23-14-15-39-103)119-92(153)71(46-58-27-31-60(134)32-28-58)124-93(154)70(45-57-21-12-9-13-22-57)123-88(149)66(26-18-42-114-102(110)111)121-94(155)74(49-79(141)142)128-97(158)80(52(3)4)130-96(157)72(47-59-29-33-61(135)34-30-59)125-95(156)73(48-78(139)140)126-87(148)65(25-17-41-113-101(108)109)118-84(145)62(104)44-56-19-10-8-11-20-56/h8-13,19-22,27-34,51-55,62-75,80-81,132-135H,14-18,23-26,35-50,103-104H2,1-7H3,(H2,105,136)(H,115,146)(H,116,147)(H,117,143)(H,118,145)(H,119,153)(H,120,152)(H,121,155)(H,122,150)(H,123,149)(H,124,154)(H,125,156)(H,126,148)(H,127,159)(H,128,158)(H,129,144)(H,130,157)(H,131,151)(H,137,138)(H,139,140)(H,141,142)(H,160,161)(H4,106,107,112)(H4,108,109,113)(H4,110,111,114)/t53-,54-,55+,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,80-,81-/m0/s1 |
| InChiKey： | InChIKey=IUOVNGJVAYCBTI-LOIPTSGXSA-N |
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