Chem
J-GLOBAL ID：200907042215738676   Nikkaji number：J1.659.540C

1-[1,4,7-Tris(phosphonomethyl)-1,4,7,10-tetraazacyclododecane-10-yl]dodecylphosphonic acid

1-[1,4,7-トリス(ホスホノメチル)-1,4,7,10-テトラアザシクロドデカン-10-イル]ドデシルホスホン酸
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： C23H54N4O12P4
Molecular formula furigana： C23-H54-N4-O12-P4
Molecular weight： 702.596
InChI： InChI=1S/C23H54N4O12P4/c1-2-3-4-5-6-7-8-9-10-11-23(43(37,38)39)27-18-16-25(21-41(31,32)33)14-12-24(20-40(28,29)30)13-15-26(17-19-27)22-42(34,35)36/h23H,2-22H2,1H3,(H2,28,29,30)(H2,31,32,33)(H2,34,35,36)(H2,37,38,39)
InChI key： VVCWSJQSFSRMND-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCC(N1CCN(CP(=O)(O)O)CCN(CP(=O)(O)O)CCN(CP(=O)(O)O)CC1)P(=O)(O)O
Systematic name  (3)：
  • 1-[1,4,7-トリス(ホスホノメチル)-1,4,7,10-テトラアザシクロドデカン-10-イル]ドデシルホスホン酸
  • {[4-(1-ホスホノドデシル)-7,10-ビス(ホスホノメチル)-1,4,7,10-テトラアザシクロドデカン-1-イル]メチル}ホスホン酸
  • {[4-(1-phosphonododecyl)-7,10-bis(phosphonomethyl)-1,4,7,10-tetraazacyclododecan-1-yl]methyl}phosphonic acid
Other name (1)：
  • 1-[1,4,7-Tris(phosphonomethyl)-1,4,7,10-tetraazacyclododecane-10-yl]dodecylphosphonic acid
Thsaurus map：
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