Chem
J-GLOBAL ID：202007012780521119
Nikkaji number：J3.751.147A
(2R,3S,4aR,8aS)-2-[(Z)-2,5-ジヒドロキシ-3-ペンテニル]ヘキサヒドロ-2H,7H-ピラノ[3,2-b]ピラン-3-オール
(2R,3S,4aR,8aS)-2-[(Z)-2,5-ジヒドロキシ-3-ペンテニル]ヘキサヒドロ-2H,7H-ピラノ[3,2-b]ピラン-3-オール
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
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
Molecular formula： C13H22O5
Molecular formula furigana： C13-H22-O5
Molecular weight： 258.314
InChI：
InChI=1S/C13H22O5/c14-5-1-3-9(15)7-12-10(16)8-13-11(18-12)4-2-6-17-13/h1,3,9-16H,2,4-8H2/b3-1-/t9?,10-,11-,12+,13+/m0/s1
InChI key：
YGTXQKHSPCAGNE-XEYPAZJFSA-N
SMILES：
O1[C@@H]([C@H](C[C@H]2OCCC[C@H]12)O)CC(/C=C\CO)O
Systematic name (3)：
- (2R,3S,4aR,8aS)-2-[(Z)-2,5-ジヒドロキシ-3-ペンテニル]ヘキサヒドロ-2H,7H-ピラノ[3,2-b]ピラン-3-オール
- (2Z)-5-[(2R,3S,4aR,8aS)-3-ヒドロキシ-オクタヒドロピラノ[3,2-b]ピラン-2-イル]ペンタ-2-エン-1,4-ジオール
- (2Z)-5-[(2R,3S,4aR,8aS)-3-hydroxy-octahydropyrano[3,2-b]pyran-2-yl]pent-2-ene-1,4-diol
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