Chem
J-GLOBAL ID:200907005115219253   Nikkaji number:J489.842G

ω-Conotoxin GVIA

ω-コノトキシンGVIA
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: C120H182N38O43S6
Molecular formula furigana: C120-H182-N38-O43-S6
Molecular weight: 3037.360
InChI: InChI=1S/C120H182N38O43S6/c1-53(165)91-114(197)138-66(10-4-6-26-122)95(178)136-68(12-8-28-132-120(129)130)98(181)149-81(107(190)139-69(93(126)176)29-55-13-19-58(167)20-14-55)50-205-204-49-80-106(189)137-67(11-7-27-131-119(127)128)96(179)144-75(42-160)104(187)151-82(108(191)143-73(36-89(125)174)116(199)157-39-62(171)33-86(157)112(195)142-71(101(184)154-91)31-57-17-23-60(169)24-18-57)51-206-207-52-84(110(193)153-80)150-100(183)72(35-88(124)173)141-99(182)70(30-56-15-21-59(168)22-16-56)140-103(186)77(44-162)146-115(198)92(54(2)166)155-113(196)87-34-63(172)40-158(87)118(201)79(46-164)148-109(192)83-48-203-202-47-64(123)94(177)135-65(9-3-5-25-121)97(180)147-78(45-163)117(200)156-38-61(170)32-85(156)111(194)133-37-90(175)134-74(41-159)102(185)145-76(43-161)105(188)152-83/h13-24,53-54,61-87,91-92,159-172H,3-12,25-52,121-123H2,1-2H3,(H2,124,173)(H2,125,174)(H2,126,176)(H,133,194)(H,134,175)(H,135,177)(H,136,178)(H,137,189)(H,138,197)(H,139,190)(H,140,186)(H,141,182)(H,142,195)(H,143,191)(H,144,179)(H,145,185)(H,146,198)(H,147,180)(H,148,192)(H,149,181)(H,150,183)(H,151,187)(H,152,188)(H,153,193)(H,154,184)(H,155,196)(H4,127,128,131)(H4,129,130,132)
InChI key: XAKGEMITPNLZBG-UHFFFAOYSA-N
SMILES: CC(O)C(NC(=O)C1CC(O)CN1C(=O)C(CO)NC(=O)C1CSSCC(N)C(=O)NC(CCCCN)C(=O)NC(CO)C(=O)N2CC(O)CC2C(=O)NCC(=O)NC(CO)C(=O)NC(CO)C(=O)N1)C(=O)NC(CO)C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(CC(=O)N)C(=O)NC1CSSCC2NC(=O)C(CO)NC(=O)C(CCCNC(=N)N)NC(=O)C(CSSCC(NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCCN)NC(=O)C(NC(=O)C(Cc3ccc(O)cc3)NC(=O)C3CC(O)CN3C(=O)C(CC(=O)N)NC2=O)C(C)O)C(=O)NC(Cc2ccc(O)cc2)C(=O)N)NC1=O
Systematic name  (3):
  • L-Cys(1)-L-Lys-L-Ser-L-t4Hyp-Gly-L-Ser-L-Ser-L-Cys(1)-L-Ser-L-t4Hyp-L-Thr-L-Ser-L-Tyr-L-Asn-L-Cys(2)-L-Cys(3)-L-Arg-L-Ser-L-Cys(2)-L-Asn-L-t4Hyp-L-Tyr-L-Thr-L-Lys-L-Arg-L-Cys(3)-L-Tyr-NH2
  • 2-{2-[2-(2-{[1-(2-{[17-アミノ-20-(4-アミノブチル)-27-ヒドロキシ-6,9,23-トリス(ヒドロキシメチル)-1,4,7,10,18,21,24-ヘプタオキソ-ヘキサコサヒドロピロロ[2,1-p]1,2-ジチア-5,8,11,14,17,20,23-ヘプタアザシクロヘキサコサン-12-イル]ホルムアミド}-3-ヒドロキシプロパノイル)-4-ヒドロキシピロリジン-2-イル]ホルムアミド}-3-ヒドロキシブタンアミド)-3-ヒドロキシプロパンアミド]-3-(4-ヒドロキシフェニル)プロパンアミド}-N-[19-(4-アミノブチル)-22,33-ビス(3-カルバムイミドアミドプロピル)-25-{[1-カルバモイル-2-(4-ヒドロキシフェニル)エチル]カルバモイル}-4-(カルバモイルメチル)-8-ヒドロキシ-16-(1-ヒドロキシエチル)-36-(ヒドロキシメチル)-13-[(4-ヒドロキシフェニル)メチル]-2,5,11,14,17,20,23,31,34,37,44-ウンデカオキソ-27,28,40,41-テトラチア-3,6,12,15,18,21,24,32,35,38,45-ウンデカアザトリシクロ[28.8.7.06,10]ペンタテトラコンタン-43-イル]ブタンジアミド
  • 2-{2-[2-(2-{[1-(2-{[17-amino-20-(4-aminobutyl)-27-hydroxy-6,9,23-tris(hydroxymethyl)-1,4,7,10,18,21,24-heptaoxo-hexacosahydropyrrolo[2,1-p]1,2-dithia-5,8,11,14,17,20,23-heptaazacyclohexacosan-12-yl]formamido}-3-hydroxypropanoyl)-4-hydroxypyrrolidin-2-yl]formamido}-3-hydroxybutanamido)-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido}-N-[19-(4-aminobutyl)-22,33-bis(3-carbamimidamidopropyl)-25-{[1-carbamoyl-2-(4-hydroxyphenyl)ethyl]carbamoyl}-4-(carbamoylmethyl)-8-hydroxy-16-(1-hydroxyethyl)-36-(hydroxymethyl)-13-[(4-hydroxyphenyl)methyl]-2,5,11,14,17,20,23,31,34,37,44-undecaoxo-27,28,40,41-tetrathia-3,6,12,15,18,21,24,32,35,38,45-undecaazatricyclo[28.8.7.06,10]pentatetracontan-43-yl]butanediamide
Other name (6):
  • ω-コノトキシンGVIA
  • ω-Conotoxin GVIA
  • ω-コノトキシンG6A
  • omega-Conotoxin GVIA
  • オメガ-コノトキシンG6A
Show all
Application (2):
NMDA antagonist ,  neurotoxin
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