Chem
J-GLOBAL ID：201307009426453479   Nikkaji number：J3.175.791F

[3β-Hydroxy-3-(1H-1,2,4-triazole-3-yl)cyclohexane-1α-yl]phosphonic acid

[3β-ヒドロキシ-3-(1H-1,2,4-トリアゾール-3-イル)シクロヘキサン-1α-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： C8H14N3O4P
Molecular formula furigana： C8-H14-N3-O4-P
Molecular weight： 247.191
InChI： InChI=1S/C8H14N3O4P/c12-8(7-9-5-10-11-7)3-1-2-6(4-8)16(13,14)15/h5-6,12H,1-4H2,(H,9,10,11)(H2,13,14,15)/t6-,8-/m0/s1
InChI key： YESMZYJHWDFHDH-XPUUQOCRSA-N
SMILES： O[C@]1(CCC[C@@H](C1)P(=O)(O)O)c1nc[nH]n1
Systematic name  (3)：
  • [3β-ヒドロキシ-3-(1H-1,2,4-トリアゾール-3-イル)シクロヘキサン-1α-イル]ホスホン酸
  • [(1S,3S)-3-ヒドロキシ-3-(1H-1,2,4-トリアゾール-3-イル)シクロヘキシル]ホスホン酸
  • [(1S,3S)-3-hydroxy-3-(1H-1,2,4-triazol-3-yl)cyclohexyl]phosphonic acid
Other name (1)：
  • [3β-Hydroxy-3-(1H-1,2,4-triazole-3-yl)cyclohexane-1α-yl]phosphonic acid
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