HIV-1 MN NO 2047

pro_cas
pro_cdbregno
CCD00416280
pro_formula
C90 H158 N30 O29
pro_molWeight
2124.42

basic_info

Product_Name: HIV-1 MN NO 2047
EnglishSynonyms: AVAEGTDRVIEVLQRAGRAI ; H-ALA-VAL-ALA-GLU-GLY-THR-ASP-ARG-VAL-ILE-GLU-VAL-LEU-GLN-ARG-ALA-GLY-ARG-ALA-ILE-OH ; HIV-1 MN NO 2047
pro_mdlNumber: MFCD03790212
pro_acceptors: 59
pro_donors: 35
pro_smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C)N
InChi: InChI=1S/C90H158N30O29/c1-18-43(11)67(119-84(145)66(42(9)10)118-78(139)52(25-22-34-101-90(97)98)110-81(142)57(36-63(129)130)114-86(147)69(49(17)121)115-60(124)38-103-74(135)53(27-30-61(125)126)108-72(133)47(15)106-82(143)64(40(5)6)116-70(131)45(13)91)85(146)112-55(28-31-62(127)128)79(140)117-65(41(7)8)83(144)113-56(35-39(3)4)80(141)111-54(26-29-58(92)122)77(138)109-51(24-21-33-100-89(95)96)76(137)104-46(14)71(132)102-37-59(123)107-50(23-20-32-99-88(93)94)75(136)105-48(16)73(134)120-68(87(148)149)44(12)19-2/h39-57,64-69,121H,18-38,91H2,1-17H3,(H2,92,122)(H,102,132)(H,103,135)(H,104,137)(H,105,136)(H,106,143)(H,107,123)(H,108,133)(H,109,138)(H,110,142)(H,111,141)(H,112,146)(H,113,144)(H,114,147)(H,115,124)(H,116,131)(H,117,140)(H,118,139)(H,119,145)(H,120,134)(H,125,126)(H,127,128)(H,129,130)(H,148,149)(H4,93,94,99)(H4,95,96,100)(H4,97,98,101)/t43-,44-,45-,46-,47-,48-,49+,50-,51-,52-,53-,54-,55-,56-,57-,64-,65-,66-,67-,68-,69-/m0/s1
InChiKey: InChIKey=MNMBINWFBIXJJL-YTLOQELGSA-N

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