SIVMAC239 ENVELOPE-80

CAS号
CCD编号
CCD00416915
分子式
C106 H182 N30 O29
分子量
2340.78

基本信息

产品名称: SIVMAC239 ENVELOPE-80
英文同义词: LSRVYQILQPILQRLSATLQ ; SIVMAC239 ENVELOPE-80 ; H-LEU-SER-ARG-VAL-TYR-GLN-ILE-LEU-GLN-PRO-ILE-LEU-GLN-ARG-LEU-SER-ALA-THR-LEU-GLN-OH
MDL号: MFCD03790849
氢键受体数量: 59
氢键供体数量: 34
Smile: CC[C@H](C)[C@@H](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](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)N)C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)N
InChi: InChI=1S/C106H182N30O29/c1-19-56(15)82(133-90(150)66(32-36-78(109)142)122-95(155)73(47-60-27-29-61(140)30-28-60)129-99(159)81(55(13)14)132-89(149)64(25-22-40-117-106(114)115)120-97(157)75(49-138)130-86(146)62(107)42-50(3)4)100(160)127-71(45-53(9)10)92(152)123-67(33-37-79(110)143)103(163)136-41-23-26-76(136)98(158)134-83(57(16)20-2)101(161)126-70(44-52(7)8)91(151)121-65(31-35-77(108)141)88(148)119-63(24-21-39-116-105(112)113)87(147)125-69(43-51(5)6)94(154)131-74(48-137)96(156)118-58(17)85(145)135-84(59(18)139)102(162)128-72(46-54(11)12)93(153)124-68(104(164)165)34-38-80(111)144/h27-30,50-59,62-76,81-84,137-140H,19-26,31-49,107H2,1-18H3,(H2,108,141)(H2,109,142)(H2,110,143)(H2,111,144)(H,118,156)(H,119,148)(H,120,157)(H,121,151)(H,122,155)(H,123,152)(H,124,153)(H,125,147)(H,126,161)(H,127,160)(H,128,162)(H,129,159)(H,130,146)(H,131,154)(H,132,149)(H,133,150)(H,134,158)(H,135,145)(H,164,165)(H4,112,113,116)(H4,114,115,117)/t56-,57-,58-,59+,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,81-,82-,83-,84-/m0/s1
InChiKey: InChIKey=PHRRVBRBOPESRC-FBLADKRVSA-N

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