基本信息 |
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| 产品名称： | SIVMAC239 ENVELOPE-67 |
| 英文同义词： | H-GLN-GLN-GLU-LYS-ASN-MET-TYR-GLU-LEU-GLN-LYS-LEU-ASN-SER-TRP-ASP-VAL-PHE-GLY-ASN-OH ; SIVMAC239 ENVELOPE-67 ; QQEKNMYELQKLNSWDVFGN |
| MDL号： | MFCD03790836 |
| 氢键受体数量： | 64 |
| 氢键供体数量： | 35 |
| Smile： | CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]c2c1cccc2)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc3ccccc3)C(=O)NCC(=O)N[C@@H](CC(=O)N)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc4ccc(cc4)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCC(=O)N)N |
| InChi： | InChI=1S/C109H163N29O35S/c1-53(2)41-70(130-98(161)68(31-36-88(150)151)127-102(165)73(44-57-23-25-59(140)26-24-57)131-99(162)69(37-40-174-7)128-104(167)75(46-83(116)144)133-94(157)64(22-14-16-39-111)124-97(160)67(30-35-87(148)149)125-95(158)65(28-33-81(114)142)122-91(154)61(112)27-32-80(113)141)100(163)126-66(29-34-82(115)143)96(159)123-63(21-13-15-38-110)93(156)129-71(42-54(3)4)101(164)134-76(47-84(117)145)105(168)137-79(52-139)107(170)132-74(45-58-50-119-62-20-12-11-19-60(58)62)103(166)135-77(49-89(152)153)106(169)138-90(55(5)6)108(171)136-72(43-56-17-9-8-10-18-56)92(155)120-51-86(147)121-78(109(172)173)48-85(118)146/h8-12,17-20,23-26,50,53-55,61,63-79,90,119,139-140H,13-16,21-22,27-49,51-52,110-112H2,1-7H3,(H2,113,141)(H2,114,142)(H2,115,143)(H2,116,144)(H2,117,145)(H2,118,146)(H,120,155)(H,121,147)(H,122,154)(H,123,159)(H,124,160)(H,125,158)(H,126,163)(H,127,165)(H,128,167)(H,129,156)(H,130,161)(H,131,162)(H,132,170)(H,133,157)(H,134,164)(H,135,166)(H,136,171)(H,137,168)(H,138,169)(H,148,149)(H,150,151)(H,152,153)(H,172,173)/t61-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,90-/m0/s1 |
| InChiKey： | InChIKey=AEGNJDZWVQTFTA-SCZFTHLESA-N |
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