Chem
J-GLOBAL ID:200907085006886308   Nikkaji number:J2.145.500H

4-[3,6-Bis(dimethylamino)xanthylium-9-yl]isophthalic acid 1-succinimidyl ester

4-[3,6-ビス(ジメチルアミノ)キサンチリウム-9-イル]イソフタル酸1-スクシンイミジル
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: C29H26N3O6[O+]
Molecular formula furigana: C29-H26-N3-O7
Molecular weight: 528.540
InChI: InChI=1S/C29H25N3O7/c1-30(2)17-6-9-20-23(14-17)38-24-15-18(31(3)4)7-10-21(24)27(20)19-8-5-16(13-22(19)28(35)36)29(37)39-32-25(33)11-12-26(32)34/h5-10,13-15H,11-12H2,1-4H3/p+1
InChI key: VWFRSNKRTNUMET-UHFFFAOYSA-O
SMILES: CN(C)c1ccc2c(c3ccc(cc3C(=O)O)C(=O)ON3C(=O)CCC3=O)c3ccc(cc3[o+]c2c1)N(C)C
Systematic name  (6):
  • 9-[4-(スクシンイミジルオキシカルボニル)-2-カルボキシフェニル]-3,6-ビス(ジメチルアミノ)キサンチリウム
  • 4-[3,6-ビス(ジメチルアミノ)キサンチリウム-9-イル]イソフタル酸1-スクシンイミジル
  • 4-[3,6-ビス(ジメチルアミノ)キサンチリウム-9-イル]-3-カルボキシ安息香酸1-スクシンイミジル
  • 9-[2-カルボキシ-4-[[(2,5-ジオキソ-1-ピロリジニル)オキシ]カルボニル]フェニル]-3,6-ビス(ジメチルアミノ)キサンチリウム
  • 9-(2-カルボキシ-4-{[(2,5-ジオキソピロリジン-1-イル)オキシ]カルボニル}フェニル)-3,6-ビス(ジメチルアミノ)-10λ4-キサンテン-10-イリウム
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Other name (4):
  • 9-[4-(Succinimidyloxycarbonyl)-2-carboxyphenyl]-3,6-bis(dimethylamino)xanthylium
  • 4-[3,6-Bis(dimethylamino)xanthylium-9-yl]isophthalic acid 1-succinimidyl ester
  • 4-[3,6-Bis(dimethylamino)xanthylium-9-yl]-3-carboxybenzoic acid 1-succinimidyl ester
  • 9-[2-Carboxy-4-[[(2,5-dioxo-1-pyrrolidinyl)oxy]carbonyl]phenyl]-3,6-bis(dimethylamino)xanthylium
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