Basic Information |
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| Product Name： | FIBULOSTATIN-6.3 |
| English Synonyms： | QPWGTCSESCGKGTQTRAR ; GLN-PRO-TRP-GLY-THR-CYS-SER-GLU-SER-CYS-GLY-LYS-GLY-THR-GLN-THR-ARG-ALA-ARG ; FIBULOSTATIN-6.3 |
| MDL Number.： | MFCD11656190 |
| H bond acceptor： | 58 |
| H bond donor： | 35 |
| Smile： | C[C@H]([C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H]([C@@H](C)O)NC(=O)CNC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CCC(=O)N)N)O |
| InChi： | InChI=1S/C82H133N29O29S2/c1-37(65(124)102-49(80(139)140)16-10-26-92-82(89)90)97-69(128)46(15-9-25-91-81(87)88)100-78(137)64(40(4)116)110-71(130)47(19-22-57(86)118)101-76(135)62(38(2)114)108-59(120)31-94-66(125)45(14-7-8-24-83)98-58(119)30-96-68(127)53(35-141)106-73(132)52(34-113)104-70(129)48(20-23-61(122)123)99-72(131)51(33-112)105-74(133)54(36-142)107-77(136)63(39(3)115)109-60(121)32-95-67(126)50(28-41-29-93-44-13-6-5-12-42(41)44)103-75(134)55-17-11-27-111(55)79(138)43(84)18-21-56(85)117/h5-6,12-13,29,37-40,43,45-55,62-64,93,112-116,141-142H,7-11,14-28,30-36,83-84H2,1-4H3,(H2,85,117)(H2,86,118)(H,94,125)(H,95,126)(H,96,127)(H,97,128)(H,98,119)(H,99,131)(H,100,137)(H,101,135)(H,102,124)(H,103,134)(H,104,129)(H,105,133)(H,106,132)(H,107,136)(H,108,120)(H,109,121)(H,110,130)(H,122,123)(H,139,140)(H4,87,88,91)(H4,89,90,92)/t37-,38+,39+,40+,43-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,62-,63-,64-/m0/s1 |
| InChiKey： | InChIKey=YIDNMUQXVJQZMY-BAPZOLLGSA-N |
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