Chem
J-GLOBAL ID：200907057073063312   Nikkaji number：J1.122.594B

Cy3

Cy3
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： C43H51N3[N+]O14S2
Molecular formula furigana： C43-H51-N4-O14-S2
Molecular weight： 912.010
InChI： InChI=1S/C43H50N4O14S2/c1-42(2)30-26-28(62(54,55)56)16-18-32(30)44(24-9-5-7-14-40(52)60-46-36(48)20-21-37(46)49)34(42)12-11-13-35-43(3,4)31-27-29(63(57,58)59)17-19-33(31)45(35)25-10-6-8-15-41(53)61-47-38(50)22-23-39(47)51/h11-13,16-19,26-27H,5-10,14-15,20-25H2,1-4H3,(H-,54,55,56,57,58,59)/p+1
InChI key： OHOQEZWSNFNUSY-UHFFFAOYSA-O
SMILES： CC1(C)C(=CC=CC2=[N+](CCCCCC(=O)ON3C(=O)CCC3=O)c3ccc(cc3C2(C)C)S(=O)(=O)O)N(CCCCCC(=O)ON2C(=O)CCC2=O)c2ccc(cc12)S(=O)(=O)O
Systematic name  (4)：
  • 1-[6-[(2,5-ジオキソ-1-ピロリジニル)オキシ]-6-オキソヘキシル]-2-[3-[1-[6-[(2,5-ジオキソ-1-ピロリジニル)オキシ]-6-オキソヘキシル]-1,3-ジヒドロ-3,3-ジメチル-5-スルホ-2H-インドール-2-イリデン]-1-プロペニル]-3,3-ジメチル-5-スルホ-3H-インドリウム
  • 1-[6-[(2,5-ジオキソ-1-ピロリジニル)オキシ]-6-オキソヘキシル]-2-[3-[1-[6-オキソ-6-[(2,5-ジオキソ-1-ピロリジニル)オキシ]ヘキシル]-3,3-ジメチル-5-スルホ-2,3-ジヒドロ-1H-インドール-2-イリデン]-1-プロペニル]-3,3-ジメチル-5-スルホ-3H-インドール-1-イウム
  • 1-{6-[(2,5-ジオキソピロリジン-1-イル)オキシ]-6-オキソヘキシル}-2-[3-(1-{6-[(2,5-ジオキソピロリジン-1-イル)オキシ]-6-オキソヘキシル}-3,3-ジメチル-5-スルホ-2,3-ジヒドロ-1H-インドール-2-イリデン)プロパ-1-エン-1-イル]-3,3-ジメチル-5-スルホ-3H-インドール-1-イウム
  • 1-{6-[(2,5-dioxopyrrolidin-1-yl)oxy]-6-oxohexyl}-2-[3-(1-{6-[(2,5-dioxopyrrolidin-1-yl)oxy]-6-oxohexyl}-3,3-dimethyl-5-sulfo-2,3-dihydro-1H-indol-2-ylidene)prop-1-en-1-yl]-3,3-dimethyl-5-sulfo-3H-indol-1-ium
Other name (4)：
  • 1-[6-[(2,5-Dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]-2-[3-[1-[6-[(2,5-dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]-1,3-dihydro-3,3-dimethyl-5-sulfo-2H-indole-2-ylidene]-1-propenyl]-3,3-dimethyl-5-sulfo-3H-indolium
  • 1-[6-[(2,5-Dioxo-1-pyrrolidinyl)oxy]-6-oxohexyl]-2-[3-[1-[6-oxo-6-[(2,5-dioxo-1-pyrrolidinyl)oxy]hexyl]-3,3-dimethyl-5-sulfo-2,3-dihydro-1H-indole-2-ylidene]-1-propenyl]-3,3-dimethyl-5-sulfo-3H-indole-1-ium
  • Cy3
  • CY-3
CAS registry number： 146397-20-8
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