Chem
J-GLOBAL ID：200907089161123103   Nikkaji number：J2.771.768C

M-119

2-(3,4,5-トリヒドロキシ-6-オキソ-6H-キサンテン-9-イル)シクロヘキサン-1-カルボン酸
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： C20H18O7
Molecular formula furigana： C20-H18-O7
Molecular weight： 370.357
InChI： InChI=1S/C20H18O7/c21-13-7-5-11-15(9-3-1-2-4-10(9)20(25)26)12-6-8-14(22)17(24)19(12)27-18(11)16(13)23/h5-10,21,23-24H,1-4H2,(H,25,26)
InChI key： CAVIJGGXNIURPI-UHFFFAOYSA-N
SMILES： OC(=O)C1CCCCC1c1c2ccc(O)c(O)c2oc2c(O)c(=O)ccc12
Systematic name  (3)：
  • 2-(3,4,5-トリヒドロキシ-6-オキソ-6H-キサンテン-9-イル)シクロヘキサン-1-カルボン酸
  • 2-(4,5,6-トリヒドロキシ-3-オキソ-3H-キサンテン-9-イル)シクロヘキサン-1-カルボン酸
  • 2-(4,5,6-trihydroxy-3-oxo-3H-xanthen-9-yl)cyclohexane-1-carboxylic acid
Other name (2)：
  • 2-(3,4,5-Trihydroxy-6-oxo-6H-xanthene-9-yl)cyclohexane-1-carboxylic acid
  • M-119
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