Pro_Molecular_Structure:
pro_cdbregno:CCD00071266
CYS-SER-ALA-SER-SER-LEU-NLE-ASP-LYS-GLU-ALA-VAL-TYR-PHE-CYS-HIS-LEU-ALA-ILE-ILE-TRP
pro_formula:C109 H163 N25 O30 S2
pro_molWeight:2367.76
* If the product has intellectual property rights, a license granted is must or contact us.
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| Product_Name： | CYS-SER-ALA-SER-SER-LEU-NLE-ASP-LYS-GLU-ALA-VAL-TYR-PHE-CYS-HIS-LEU-ALA-ILE-ILE-TRP |
| EnglishSynonyms： | CYS-SER-ALA-SER-SER-LEU-NLE-ASP-LYS-GLU-ALA-VAL-TYR-PHE-CYS-HIS-LEU-ALA-ILE-ILE-TRP ; [ALA3,11,18, NLE7] ENDOTHELIN-1, HUMAN ; [ALA3,11,18, NLE7] ET-1, HUMAN |
| pro_mdlNumber： | MFCD00143564 |
| pro_acceptors： | 55 |
| pro_donors： | 31 |
| pro_smile： | CCCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC(C)C)CO)CO)C)CO)N)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](Cc3c[nH]c4c3cccc4)C(=O)O)Cc5ccccc5)Cc6ccc(cc6)O)C(C)C)C)CCC(=O)O)CCCCN)CC(=O)O |
| InChi： | InChI=1S/C109H163N25O30S2/c1-15-18-29-70-95(149)125-78(45-85(141)142)101(155)119-71(31-24-25-38-110)94(148)120-72(36-37-84(139)140)93(147)115-60(13)90(144)132-86(56(8)9)106(160)126-76(42-63-32-34-66(138)35-33-63)98(152)123-75(41-62-26-20-19-21-27-62)99(153)131-83(52-166-165-51-68(111)92(146)129-80(48-135)102(156)117-59(12)89(143)128-81(49-136)104(158)130-82(50-137)103(157)122-74(40-55(6)7)97(151)118-70)105(159)124-77(44-65-47-112-53-114-65)100(154)121-73(39-54(4)5)96(150)116-61(14)91(145)133-88(58(11)17-3)108(162)134-87(57(10)16-2)107(161)127-79(109(163)164)43-64-46-113-69-30-23-22-28-67(64)69/h19-23,26-28,30,32-35,46-47,53-61,68,70-83,86-88,113,135-138H,15-18,24-25,29,31,36-45,48-52,110-111H2,1-14H3,(H,112,114)(H,115,147)(H,116,150)(H,117,156)(H,118,151)(H,119,155)(H,120,148)(H,121,154)(H,122,157)(H,123,152)(H,124,159)(H,125,149)(H,126,160)(H,127,161)(H,128,143)(H,129,146)(H,130,158)(H,131,153)(H,132,144)(H,133,145)(H,134,162)(H,139,140)(H,141,142)(H,163,164)/t57-,58-,59-,60-,61-,68-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,86-,87-,88-/m0/s1 |
| InChiKey： | InChIKey=FJRHWZDDJZSFGX-AQSJZLJZSA-N |
basic_info
* If the product has intellectual property rights, a license granted is must or contact us.
