Chem
J-GLOBAL ID：200907032019833843   Nikkaji number：J1.674.843I

6,13-Dihydroxy-6,13-dioxo-1,4,8,11-tetraaza-6,13-diphospha(V)cyclotetradecane-1,4,8,11-tetraacetic acid

6,13-ジヒドロキシ-6,13-ジオキソ-1,4,8,11-テトラアザ-6,13-ジホスファ(V)シクロテトラデカン-1,4,8,11-四酢酸
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： C16H30N4O12P2
Molecular formula furigana： C16-H30-N4-O12-P2
Molecular weight： 532.380
InChI： InChI=1S/C16H30N4O12P2/c21-13(22)5-17-1-2-18(6-14(23)24)10-34(31,32)12-20(8-16(27)28)4-3-19(7-15(25)26)11-33(29,30)9-17/h1-12H2,(H,21,22)(H,23,24)(H,25,26)(H,27,28)(H,29,30)(H,31,32)
InChI key： ZNLYRVPHOBHXEM-UHFFFAOYSA-N
SMILES： OC(=O)CN1CCN(CC(=O)O)CP(=O)(O)CN(CC(=O)O)CCN(CC(=O)O)CP(=O)(O)C1
Systematic name  (3)：
  • 6,13-ジヒドロキシ-6,13-ジオキソ-1,4,8,11-テトラアザ-6,13-ジホスファ(V)シクロテトラデカン-1,4,8,11-四酢酸
  • 2-[5,8,12-トリス(カルボキシメチル)-3,10-ジヒドロキシ-3,10-ジオキソ-1,5,8,12-テトラアザ-3λ5,10λ5-ジホスファシクロテトラデカン-1-イル]酢酸
  • 2-[5,8,12-tris(carboxymethyl)-3,10-dihydroxy-3,10-dioxo-1,5,8,12-tetraaza-3λ5,10λ5-diphosphacyclotetradecan-1-yl]acetic acid
Other name (1)：
  • 6,13-Dihydroxy-6,13-dioxo-1,4,8,11-tetraaza-6,13-diphospha(V)cyclotetradecane-1,4,8,11-tetraacetic acid
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