Chem
J-GLOBAL ID：200907057607523861   Nikkaji number：J652.691H

ω-Conotoxin M-VIIC

ω-コノトキシンM-VIIC
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C106H178N40O32S7
Molecular formula furigana： C106-H178-N40-O32-S7
Molecular weight： 2749.260
InChI： InChI=1S/C106H178N40O32S7/c1-53-103(178)146-36-15-23-75(146)101(176)144-74-52-185-183-49-71-89(164)126-43-79(154)130-62(21-13-34-120-105(115)116)90(165)133-60(20-12-33-119-104(113)114)87(162)124-42-78(153)129-61(18-6-10-31-109)91(166)140-70(83(112)158)48-181-184-51-73(100(175)143-72(99(174)139-68(45-147)88(163)125-44-80(155)131-69(46-148)97(172)141-71)50-182-180-47-57(111)84(159)132-59(17-5-9-30-108)86(161)123-41-77(152)128-58(16-4-8-29-107)85(160)122-40-76(151)127-53)142-96(171)67(39-81(156)157)138-95(170)66(38-55-24-26-56(150)27-25-55)137-93(168)65(28-37-179-3)136-102(177)82(54(2)149)145-94(169)63(19-7-11-32-110)134-92(167)64(135-98(74)173)22-14-35-121-106(117)118/h24-27,53-54,57-75,82,147-150H,4-23,28-52,107-111H2,1-3H3,(H2,112,158)(H,122,160)(H,123,161)(H,124,162)(H,125,163)(H,126,164)(H,127,151)(H,128,152)(H,129,153)(H,130,154)(H,131,155)(H,132,159)(H,133,165)(H,134,167)(H,135,173)(H,136,177)(H,137,168)(H,138,170)(H,139,174)(H,140,166)(H,141,172)(H,142,171)(H,143,175)(H,144,176)(H,145,169)(H,156,157)(H4,113,114,119)(H4,115,116,120)(H4,117,118,121)
InChI key： FHVUTHWUIUXZBY-UHFFFAOYSA-N
SMILES： CSCCC1NC(=O)C(NC(=O)C(CCCCN)NC(=O)C(CCCNC(=N)N)NC(=O)C2CSSCC3NC(=O)C(CO)NC(=O)CNC(=O)C(CO)NC(=O)C(CSSCC(N)C(=O)NC(CCCCN)C(=O)NCC(=O)NC(CCCCN)C(=O)NCC(=O)NC(C)C(=O)N4CCCC4C(=O)N2)NC(=O)C(CSSCC(NC(=O)C(CCCCN)NC(=O)CNC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)CNC3=O)C(=O)N)NC(=O)C(CC(=O)O)NC(=O)C(Cc2ccc(O)cc2)NC1=O)C(C)O
Systematic name  (3)：
  • L-Cys(1)-L-Lys-Gly-L-Lys-Gly-L-Ala-L-Pro-L-Cys(2)-L-Arg-L-Lys-L-Thr-L-Met-L-Tyr-L-Asp-L-Cys(3)-L-Cys(1)-L-Ser-Gly-L-Ser-L-Cys(2)-Gly-L-Arg-L-Arg-Gly-L-Lys-L-Cys(3)-NH2
  • 2-[62-アミノ-7,30,65,71-テトラキス(4-アミノブチル)-4,36,39-トリス(3-カルバムイミドアミドプロピル)-27-カルバモイル-10-(1-ヒドロキシエチル)-48,54-ビス(ヒドロキシメチル)-16-[(4-ヒドロキシフェニル)メチル]-77-メチル-13-[2-(メチルスルファニル)エチル]-2,5,8,11,14,17,20,29,32,35,38,41,44,47,50,53,56,63,66,69,72,75,78,84,91-ペンタコサオキソ-24,25,59,60,87,88-ヘキサチア-3,6,9,12,15,18,21,28,31,34,37,40,43,46,49,52,55,64,67,70,73,76,79,85,90-ペンタコサアザテトラシクロ[43.40.4.222,57.079,83]ヘンノナコンタン-19-イル]酢酸
  • 2-[62-amino-7,30,65,71-tetrakis(4-aminobutyl)-4,36,39-tris(3-carbamimidamidopropyl)-27-carbamoyl-10-(1-hydroxyethyl)-48,54-bis(hydroxymethyl)-16-[(4-hydroxyphenyl)methyl]-77-methyl-13-[2-(methylsulfanyl)ethyl]-2,5,8,11,14,17,20,29,32,35,38,41,44,47,50,53,56,63,66,69,72,75,78,84,91-pentacosaoxo-24,25,59,60,87,88-hexathia-3,6,9,12,15,18,21,28,31,34,37,40,43,46,49,52,55,64,67,70,73,76,79,85,90-pentacosaazatetracyclo[43.40.4.222,57.079,83]hennonacontan-19-yl]acetic acid
Other name (6)：
  • ω-コノトキシンM-VIIC
  • ω-Conotoxin M-VIIC
  • ω-コノトキシン-MVIIC
  • ω-Conotoxin MVIIC
  • ω-コノトキシンMVIIC
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CAS registry number： 147794-23-8
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