HXB2 GAG NO 60/AA237-251_ChemCD

HXB2 GAG NO 60/AA237-251

basic_info
Product_Name：	HXB2 GAG NO 60/AA237-251
EnglishSynonyms：	HXB2 GAG NO 60/AA237-251 ; H-ALA-GLY-THR-THR-SER-THR-LEU-GLN-GLU-GLN-ILE-GLY-TRP-MET-THR-OH ; AGTTSTLQEQIGWMT
pro_mdlNumber：	MFCD03790536
pro_acceptors：	43
pro_donors：	25
pro_smile：	CC[C@H](C)[C@@H](C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N[C@@H](CCSC)C(=O)N[C@@H]([C@@H](C)O)C(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)CNC(=O)[C@H](C)N
InChi：	InChI=1S/C69H110N18O25S/c1-11-31(4)52(65(107)75-27-49(95)76-45(25-37-26-73-39-15-13-12-14-38(37)39)63(105)80-43(22-23-113-10)61(103)87-56(36(9)92)69(111)112)84-60(102)41(17-20-48(72)94)77-59(101)42(18-21-51(97)98)78-58(100)40(16-19-47(71)93)79-62(104)44(24-30(2)3)81-66(108)54(34(7)90)85-64(106)46(29-88)82-67(109)55(35(8)91)86-68(110)53(33(6)89)83-50(96)28-74-57(99)32(5)70/h12-15,26,30-36,40-46,52-56,73,88-92H,11,16-25,27-29,70H2,1-10H3,(H2,71,93)(H2,72,94)(H,74,99)(H,75,107)(H,76,95)(H,77,101)(H,78,100)(H,79,104)(H,80,105)(H,81,108)(H,82,109)(H,83,96)(H,84,102)(H,85,106)(H,86,110)(H,87,103)(H,97,98)(H,111,112)/t31-,32-,33+,34+,35+,36+,40-,41-,42-,43-,44-,45-,46-,52-,53-,54-,55-,56-/m0/s1
InChiKey：	InChIKey=ZMLKPDVNXVFXAF-HVTYYXOUSA-N

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