basic_info |
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| Product_Name： | BIOTINYL-(GLU1)-GASTRIN I (HUMAN) (PHOSPHORYLATED) |
| EnglishSynonyms： | BIOTINYL-(GLU1)-GASTRIN I (PHOSPHORYLATED), HUMAN ; BIOTINYL-GLU-GLY-PRO-TRP-LEU-GLU-GLU-GLU-GLU-GLU-ALA-TYR(PO3H2)-GLY-TRP-MET-ASP-PHE-NH2 ; BIOTINYL-(GLU1)-GASTRIN I (HUMAN) (PHOSPHORYLATED) ; BIOTIN-GLU-GLY-PRO-TRP-LEU-GLU-GLU-GLU-GLU-GLU-ALA-TYR(PO3H2)-GLY-TRP-MET-ASP-PHE-NH2 ; BIOTIN-[GLU1]-GASTRIN I (HUMAN) (PHOSPHORYLATED) |
| pro_mdlNumber： | MFCD06858293 |
| pro_acceptors： | 59 |
| pro_donors： | 30 |
| pro_smile： | CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(cc1)OP(=O)(O)O)C(=O)NCC(=O)N[C@@H](Cc2c[nH]c3c2cccc3)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc4ccccc4)C(=O)N)NC(=O)[C@H](Cc5c[nH]c6c5cccc6)NC(=O)[C@@H]7CCCN7C(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)CCCC[C@H]8[C@@H]9[C@H](CS8)NC(=O)N9 |
| InChi： | InChI=1S/C107H141N22O37PS2/c1-54(2)43-73(124-104(159)76(47-59-50-110-64-20-11-9-18-62(59)64)126-106(161)79-21-14-41-129(79)83(132)52-112-94(149)65(28-34-84(133)134)114-81(130)23-13-12-22-80-91-78(53-169-80)127-107(162)128-91)102(157)120-70(33-39-89(143)144)100(155)119-69(32-38-88(141)142)99(154)118-68(31-37-87(139)140)98(153)117-67(30-36-86(137)138)97(152)116-66(29-35-85(135)136)96(151)113-55(3)93(148)123-74(45-57-24-26-60(27-25-57)166-167(163,164)165)95(150)111-51-82(131)115-75(46-58-49-109-63-19-10-8-17-61(58)63)103(158)121-71(40-42-168-4)101(156)125-77(48-90(145)146)105(160)122-72(92(108)147)44-56-15-6-5-7-16-56/h5-11,15-20,24-27,49-50,54-55,65-80,91,109-110H,12-14,21-23,28-48,51-53H2,1-4H3,(H2,108,147)(H,111,150)(H,112,149)(H,113,151)(H,114,130)(H,115,131)(H,116,152)(H,117,153)(H,118,154)(H,119,155)(H,120,157)(H,121,158)(H,122,160)(H,123,148)(H,124,159)(H,125,156)(H,126,161)(H,133,134)(H,135,136)(H,137,138)(H,139,140)(H,141,142)(H,143,144)(H,145,146)(H2,127,128,162)(H2,163,164,165)/t55-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,91-/m0/s1 |
| InChiKey： | InChIKey=YWZMBXMQURQEQQ-CNCIPMBJSA-N |
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