Chem
J-GLOBAL ID:200907017733076542
Nikkaji number:J1.240.143D
(1S,3R)-1-[(4S,4′S)-2,2,2′,2′-Tetramethyl-4,4′-bi[1,3-dioxolane]-5α-yl]-3-[[(3aS,3aα,6aα)-2,2-dimethyl-6α-methoxytetrahydrofuro[3,4-d]-1,3-dioxole]-4β-yl]-1,3-propanediol
(1S,3R)-1-[(4S,4′S)-2,2,2′,2′-テトラメチル-4,4′-ビ[1,3-ジオキソラン]-5α-イル]-3-[[(3aS,3aα,6aα)-2,2-ジメチル-6α-メトキシテトラヒドロフロ[3,4-d]-1,3-ジオキソール]-4β-イル]-1,3-プロパンジオール
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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:
C21 H36 O10
Molecular formula furigana:
C21-H36-O10
Molecular weight:
448.509
InChI:
InChI=1S/C21H36O10/c1-19(2)25-9-12(27-19)15-14(28-20(3,4)29-15)11(23)8-10(22)13-16-17(18(24-7)26-13)31-21(5,6)30-16/h10-18,22-23H,8-9H2,1-7H3/t10-,11+,12+,13-,14+,15+,16+,17+,18+/m1/s1
InChI key:
NKEPERDDWZLECJ-UJBFQJRTSA-N
SMILES:
CO[C@H]1O[C@H]([C@H](O)C[C@H](O)[C@@H]2OC(C)(C)O[C@H]2[C@@H]2COC(C)(C)O2)[C@@H]2OC(C)(C)O[C@H]12
Systematic name (3):
(1S,3R)-1-[(4S,4′S)-2,2,2′,2′-テトラメチル-4,4′-ビ[1,3-ジオキソラン]-5α-イル]-3-[[(3aS,3aα,6aα)-2,2-ジメチル-6α-メトキシテトラヒドロフロ[3,4-d]-1,3-ジオキソール]-4β-イル]-1,3-プロパンジオール
(1R,3S)-1-[(3aS,4R,6S,6aS)-6-メトキシ-2,2-ジメチル-テトラヒドロ-2H-フロ[3,4-d][1,3]ジオキソール-4-イル]-3-[(4S,5S)-5-[(4S)-2,2-ジメチル-1,3-ジオキソラン-4-イル]-2,2-ジメチル-1,3-ジオキソラン-4-イル]プロパン-1,3-ジオール
(1R,3S)-1-[(3aS,4R,6S,6aS)-6-methoxy-2,2-dimethyl-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]-3-[(4S,5S)-5-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-1,3-dioxolan-4-yl]propane-1,3-diol
Other name (1):
(1S,3R)-1-[(4S,4′S)-2,2,2′,2′-Tetramethyl-4,4′-bi[1,3-dioxolane]-5α-yl]-3-[[(3aS,3aα,6aα)-2,2-dimethyl-6α-methoxytetrahydrofuro[3,4-d]-1,3-dioxole]-4β-yl]-1,3-propanediol
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