Chem
J-GLOBAL ID：200907041425603114
Nikkaji number：J2.061.204E
8-(2H)Hydroxy-1,3,6-pyrenetrisulfonic acidanion
8-[(2H)オキシ]ピレン-1,3,6-トリスルホナート
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
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
Molecular formula： C16H6[2H]O7[O-]3S3
Molecular formula furigana： C16-H7-O10-S3
Molecular weight： 456.410
InChI：
InChI=1S/C16H10O10S3/c17-11-5-12(27(18,19)20)8-3-4-10-14(29(24,25)26)6-13(28(21,22)23)9-2-1-7(11)15(8)16(9)10/h1-6,17H,(H,18,19,20)(H,21,22,23)(H,24,25,26)/p-3/i/hD
InChI key：
OBJOZRVSMLPASY-DYCDLGHISA-K
SMILES：
O([2H])c1cc(c2ccc3c(cc(c4ccc1c2c34)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]
Systematic name (3)：
- 8-(2H)ヒドロキシ-1,3,6-ピレントリスルホン酸アニオン
- 8-[(2H)オキシ]ピレン-1,3,6-トリスルホナート
- 8-[(2H)oxy]pyrene-1,3,6-trisulfonate
- 8-(2H)Hydroxy-1,3,6-pyrenetrisulfonic acidanion
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