Chem
J-GLOBAL ID：202007015689763443   Nikkaji number：J3.752.030F

6-({4,7-bis[(6-phosphonopyridin-2-yl)methyl]-1,4,7-triazonan-1-yl}methyl)pyridin-2-ylphosphonic acid

6-({4,7-ビス[(6-ホスホノピリジン-2-イル)メチル]-1,4,7-トリアゾナン-1-イル}メチル)ピリジン-2-イルホスホン酸
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： C24H33N6O9P3
Molecular formula furigana： C24-H33-N6-O9-P3
Molecular weight： 642.482
InChI： InChI=1S/C24H33N6O9P3/c31-40(32,33)22-7-1-4-19(25-22)16-28-10-12-29(17-20-5-2-8-23(26-20)41(34,35)36)14-15-30(13-11-28)18-21-6-3-9-24(27-21)42(37,38)39/h1-9H,10-18H2,(H2,31,32,33)(H2,34,35,36)(H2,37,38,39)
InChI key： RNWLFJAAYDDOHC-UHFFFAOYSA-N
SMILES： N1(CCN(CCN(CC1)Cc1nc(ccc1)P(=O)(O)O)Cc1nc(ccc1)P(=O)(O)O)Cc1nc(ccc1)P(=O)(O)O
Systematic name  (3)：
  • 1,4,7-トリス[(6-ホスホノピリジン-2-イル)メチル]-1,4,7-トリアザシクロノナン
  • [6-({4,7-ビス[(6-ホスホノピリジン-2-イル)メチル]-1,4,7-トリアゾナン-1-イル}メチル)ピリジン-2-イル]ホスホン酸
  • [6-({4,7-bis[(6-phosphonopyridin-2-yl)methyl]-1,4,7-triazonan-1-yl}methyl)pyridin-2-yl]phosphonic acid
Other name (2)：
  • 6-({4,7-ビス[(6-ホスホノピリジン-2-イル)メチル]-1,4,7-トリアゾナン-1-イル}メチル)ピリジン-2-イルホスホン酸
  • 6-({4,7-bis[(6-phosphonopyridin-2-yl)methyl]-1,4,7-triazonan-1-yl}methyl)pyridin-2-ylphosphonic acid
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