Chem
J-GLOBAL ID：200907000712662603   Nikkaji number：J630.088J

(1S)-1,3β,4α-Trihydroxy-5α-(2-phosphonoethyl)cyclohexane-1β-carboxylic acid

(1S)-1,3β,4α-トリヒドロキシ-5α-(2-ホスホノエチル)シクロヘキサン-1β-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： C9H17O8P
Molecular formula furigana： C9-H17-O8-P
Molecular weight： 284.201
InChI： InChI=1S/C9H17O8P/c10-6-4-9(14,8(12)13)3-5(7(6)11)1-2-18(15,16)17/h5-7,10-11,14H,1-4H2,(H,12,13)(H2,15,16,17)/t5-,6-,7-,9+/m1/s1
InChI key： YXLPXVCLCOEVLV-PULFBKJNSA-N
SMILES： O[C@@H]1C[C@@](O)(C[C@@H](CCP(=O)(O)O)[C@H]1O)C(=O)O
Systematic name  (3)：
  • (1S)-1,3β,4α-トリヒドロキシ-5α-(2-ホスホノエチル)シクロヘキサン-1β-カルボン酸
  • (1S,3R,4R,5S)-1,3,4-トリヒドロキシ-5-(2-ホスホノエチル)シクロヘキサン-1-カルボン酸
  • (1S,3R,4R,5S)-1,3,4-trihydroxy-5-(2-phosphonoethyl)cyclohexane-1-carboxylic acid
Other name (1)：
  • (1S)-1,3β,4α-Trihydroxy-5α-(2-phosphonoethyl)cyclohexane-1β-carboxylic acid
Thsaurus map：
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