Chem
J-GLOBAL ID:200907009151803846   Nikkaji number:J1.576.536D

(1R,1β,6β)-3α,5β-Dihydroxy-8β-methyl-8-(1,1-dimethoxyethyl)-7,9-dioxabicyclo[4.3.0]nonane-3β-carboxylic acid γ-lactone

(1R,1β,6β)-3α,5β-ジヒドロキシ-8β-メチル-8-(1,1-ジメトキシエチル)-7,9-ジオキサビシクロ[4.3.0]ノナン-3β-カルボン酸γ-ラクトン
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: C13H20O7
Molecular formula furigana: C13-H20-O7
Molecular weight: 288.296
InChI: InChI=1S/C13H20O7/c1-11(16-3,17-4)12(2)19-8-6-13(15)5-7(9(8)20-12)18-10(13)14/h7-9,15H,5-6H2,1-4H3/t7-,8-,9+,12-,13-/m1/s1
InChI key: GHOMSUNIEOBLLZ-OQQJQLSSSA-N
SMILES: COC(C)(OC)[C@]1(C)O[C@@H]2C[C@]3(O)C[C@@H](OC3=O)[C@@H]2O1
Systematic name  (3):
  • (1R,1β,6β)-3α,5β-ジヒドロキシ-8β-メチル-8-(1,1-ジメトキシエチル)-7,9-ジオキサビシクロ[4.3.0]ノナン-3β-カルボン酸γ-ラクトン
  • (1R,2R,4R,6R,8S)-4-(1,1-ジメトキシエチル)-8-ヒドロキシ-4-メチル-3,5,10-トリオキサトリシクロ[6.2.1.02,6]ウンデカン-9-オン
  • (1R,2R,4R,6R,8S)-4-(1,1-dimethoxyethyl)-8-hydroxy-4-methyl-3,5,10-trioxatricyclo[6.2.1.02,6]undecan-9-one
Other name (1):
  • (1R,1β,6β)-3α,5β-Dihydroxy-8β-methyl-8-(1,1-dimethoxyethyl)-7,9-dioxabicyclo[4.3.0]nonane-3β-carboxylic acid γ-lactone
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