basic_info |
|
| Product_Name： | SIVMAC239 ENVELOPE-70 |
| EnglishSynonyms： | H-ILE-GLN-TYR-GLY-VAL-TYR-ILE-VAL-VAL-GLY-VAL-ILE-LEU-LEU-ARG-ILE-VAL-ILE-TYR-ILE-OH ; IQYGVYIVVGVILLRIVIYI ; SIVMAC239 ENVELOPE-70 |
| pro_mdlNumber： | MFCD03790839 |
| pro_acceptors： | 49 |
| pro_donors： | 28 |
| pro_smile： | CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](Cc1ccc(cc1)O)C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc2ccc(cc2)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc3ccc(cc3)O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)O)N |
| InChi： | InChI=1S/C115H188N24O25/c1-27-64(21)86(117)104(153)124-77(47-48-83(116)143)98(147)126-80(52-70-35-41-73(140)42-36-70)97(146)121-55-84(144)130-88(60(13)14)106(155)128-81(53-71-37-43-74(141)44-38-71)102(151)136-95(68(25)31-5)113(162)133-90(62(17)18)108(157)132-87(59(11)12)105(154)122-56-85(145)131-89(61(15)16)107(156)137-92(65(22)28-2)110(159)127-79(51-58(9)10)101(150)125-78(50-57(7)8)100(149)123-76(34-33-49-120-115(118)119)99(148)135-94(67(24)30-4)112(161)134-91(63(19)20)109(158)138-93(66(23)29-3)111(160)129-82(54-72-39-45-75(142)46-40-72)103(152)139-96(114(163)164)69(26)32-6/h35-46,57-69,76-82,86-96,140-142H,27-34,47-56,117H2,1-26H3,(H2,116,143)(H,121,146)(H,122,154)(H,123,149)(H,124,153)(H,125,150)(H,126,147)(H,127,159)(H,128,155)(H,129,160)(H,130,144)(H,131,145)(H,132,157)(H,133,162)(H,134,161)(H,135,148)(H,136,151)(H,137,156)(H,138,158)(H,139,152)(H,163,164)(H4,118,119,120)/t64-,65-,66-,67-,68-,69-,76-,77-,78-,79-,80-,81-,82-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-/m0/s1 |
| InChiKey： | InChIKey=WFFSYCJYPCCMBP-YCUWZJDPSA-N |
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