Basic Information |
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| Product Name： | 2B-(A) |
| English Synonyms： | BIOTIN-RRAAEELDSRAGAPQL ; 2B-(A) ; BIOTIN-(ARG)(ARG)(ALA)(ALA)(GLU)(GLU)(LEU)(ASP)(SER)(ARG)(ALA)(GLY)(ALA)(PRO)(GLN)(LEU) ; BIOTIN-ARG-ARG-ALA-ALA-GLU-GLU-LEU-ASP-SER-ARG-ALA-GLY-ALA-PRO-GLN-LEU-OH |
| MDL Number.： | MFCD03093664 |
| H bond acceptor： | 55 |
| H bond donor： | 32 |
| Smile： | CC(C)C[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CCCC[C@H]2[C@@H]3[C@H](CS2)NC(=O)N3 |
| InChi： | InChI=1S/C81H136N28O27S/c1-37(2)31-49(72(129)104-50(33-61(118)119)73(130)106-52(35-110)74(131)100-45(17-13-29-91-80(87)88)66(123)95-39(5)63(120)92-34-58(113)93-42(8)76(133)109-30-14-18-54(109)75(132)102-46(21-24-56(82)111)71(128)105-51(77(134)135)32-38(3)4)103-70(127)48(23-26-60(116)117)101-69(126)47(22-25-59(114)115)98-65(122)41(7)94-64(121)40(6)96-67(124)44(16-12-28-90-79(85)86)99-68(125)43(15-11-27-89-78(83)84)97-57(112)20-10-9-19-55-62-53(36-137-55)107-81(136)108-62/h37-55,62,110H,9-36H2,1-8H3,(H2,82,111)(H,92,120)(H,93,113)(H,94,121)(H,95,123)(H,96,124)(H,97,112)(H,98,122)(H,99,125)(H,100,131)(H,101,126)(H,102,132)(H,103,127)(H,104,129)(H,105,128)(H,106,130)(H,114,115)(H,116,117)(H,118,119)(H,134,135)(H4,83,84,89)(H4,85,86,90)(H4,87,88,91)(H2,107,108,136)/t39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,62-/m0/s1 |
| InChiKey： | InChIKey=WGXPJWHDGGKWRY-LADUJLPUSA-N |
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