Chem
J-GLOBAL ID:200907051435218370   Nikkaji number:J1.762.997B

1β-Mercapto-5β-(hydroxymethyl)cyclohexane-2α,3α,4β-triol

1β-メルカプト-5β-(ヒドロキシメチル)シクロヘキサン-2α,3α,4β-トリオール
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: C7H14O4S
Molecular formula furigana: C7-H14-O4-S
Molecular weight: 194.250
InChI: InChI=1S/C7H14O4S/c8-2-3-1-4(12)6(10)7(11)5(3)9/h3-12H,1-2H2/t3-,4-,5+,6+,7-/m1/s1
InChI key: WWOACYWPOPRNET-ULQPCXBYSA-N
SMILES: OC[C@H]1C[C@@H](S)[C@H](O)[C@H](O)[C@H]1O
Systematic name  (3):
  • 1β-メルカプト-5β-(ヒドロキシメチル)シクロヘキサン-2α,3α,4β-トリオール
  • (1R,2R,3S,4R,6R)-4-(ヒドロキシメチル)-6-スルファニルシクロヘキサン-1,2,3-トリオール
  • (1R,2R,3S,4R,6R)-4-(hydroxymethyl)-6-sulfanylcyclohexane-1,2,3-triol
Other name (1):
  • 1β-Mercapto-5β-(hydroxymethyl)cyclohexane-2α,3α,4β-triol
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