基本信息 |
|
| 产品名称： | SIVMAC239 ENVELOPE-52 |
| 英文同义词： | DVKRYTTGGTSRNKRGVFVL ; SIVMAC239 ENVELOPE-52 ; H-ASP-VAL-LYS-ARG-TYR-THR-THR-GLY-GLY-THR-SER-ARG-ASN-LYS-ARG-GLY-VAL-PHE-VAL-LEU-OH |
| MDL号： | MFCD03790821 |
| 氢键受体数量： | 61 |
| 氢键供体数量： | 39 |
| Smile： | CC(C)C[C@@H](C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)CNC(=O)CNC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC(=O)O)N |
| InChi： | InChI=1S/C98H164N32O29/c1-47(2)38-66(95(158)159)123-92(155)75(50(7)8)128-86(149)64(39-54-22-13-12-14-23-54)122-90(153)73(48(3)4)125-71(139)45-113-80(143)58(26-19-35-109-96(103)104)115-81(144)59(24-15-17-33-99)117-85(148)65(42-68(102)136)121-84(147)62(28-21-37-111-98(107)108)118-88(151)67(46-131)124-93(156)77(52(10)133)126-70(138)44-112-69(137)43-114-89(152)76(51(9)132)130-94(157)78(53(11)134)129-87(150)63(40-55-29-31-56(135)32-30-55)120-83(146)61(27-20-36-110-97(105)106)116-82(145)60(25-16-18-34-100)119-91(154)74(49(5)6)127-79(142)57(101)41-72(140)141/h12-14,22-23,29-32,47-53,57-67,73-78,131-135H,15-21,24-28,33-46,99-101H2,1-11H3,(H2,102,136)(H,112,137)(H,113,143)(H,114,152)(H,115,144)(H,116,145)(H,117,148)(H,118,151)(H,119,154)(H,120,146)(H,121,147)(H,122,153)(H,123,155)(H,124,156)(H,125,139)(H,126,138)(H,127,142)(H,128,149)(H,129,150)(H,130,157)(H,140,141)(H,158,159)(H4,103,104,109)(H4,105,106,110)(H4,107,108,111)/t51-,52-,53-,57+,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+,73+,74+,75+,76+,77+,78+/m1/s1 |
| InChiKey： | InChIKey=RSNFGHQBZNSXDH-VFSRLDEVSA-N |
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