Molecular Structure:
CCD No.:CCD00118303
GP41 (578-594)
Formula:C93 H161 N27 O25
MolWeight:2057.46
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| Product Name： | GP41 (578-594) |
| English Synonyms： | ILE-LYS-GLN-LEU-GLN-ALA-ARG-ILE-LEU-ALA-VAL-GLU-ARG-TYR-LEU-LYS-ASP ; GP41 (578-594) |
| MDL Number.： | MFCD00273601 |
| H bond acceptor： | 52 |
| H bond donor： | 31 |
| Smile： | CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)O)N |
| InChi： | InChI=1S/C93H161N27O25/c1-15-50(11)72(98)88(141)112-57(24-18-20-38-95)78(131)110-61(32-35-69(97)123)82(135)114-64(42-47(5)6)86(139)111-60(31-34-68(96)122)77(130)105-52(13)75(128)107-59(26-22-40-104-93(101)102)83(136)120-74(51(12)16-2)90(143)117-63(41-46(3)4)84(137)106-53(14)76(129)119-73(49(9)10)89(142)113-62(33-36-70(124)125)81(134)108-58(25-21-39-103-92(99)100)79(132)116-66(44-54-27-29-55(121)30-28-54)87(140)115-65(43-48(7)8)85(138)109-56(23-17-19-37-94)80(133)118-67(91(144)145)45-71(126)127/h27-30,46-53,56-67,72-74,121H,15-26,31-45,94-95,98H2,1-14H3,(H2,96,122)(H2,97,123)(H,105,130)(H,106,137)(H,107,128)(H,108,134)(H,109,138)(H,110,131)(H,111,139)(H,112,141)(H,113,142)(H,114,135)(H,115,140)(H,116,132)(H,117,143)(H,118,133)(H,119,129)(H,120,136)(H,124,125)(H,126,127)(H,144,145)(H4,99,100,103)(H4,101,102,104)/t50-,51-,52-,53-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,72-,73-,74-/m0/s1 |
| InChiKey： | InChIKey=MQTSDDUNGFPPBG-PSZNKETDSA-N |
Basic Information
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