Chem
J-GLOBAL ID:200907024760964979
Nikkaji number:J2.685.894A
1-O,6-O-Dibenzoyl-2-O-isopropyl-3-O,4-O-isopropylidene-β-D-psicofuranose
1-O,6-O-ジベンゾイル-2-O-イソプロピル-3-O,4-O-イソプロピリデン-β-D-プシコフラノース
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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:
C26 H30 O8
Molecular formula furigana:
C26-H30-O8
Molecular weight:
470.518
InChI:
InChI=1S/C26H30O8/c1-17(2)31-26(16-30-24(28)19-13-9-6-10-14-19)22-21(33-25(3,4)34-22)20(32-26)15-29-23(27)18-11-7-5-8-12-18/h5-14,17,20-22H,15-16H2,1-4H3/t20-,21-,22-,26-/m1/s1
InChI key:
UNWMUOOAEXBTRW-PIXQIBFHSA-N
SMILES:
CC(C)O[C@]1(COC(=O)c2ccccc2)O[C@H](COC(=O)c2ccccc2)[C@H]2OC(C)(C)O[C@@H]12
Systematic name (3):
1-O,6-O-ジベンゾイル-2-O-イソプロピル-3-O,4-O-イソプロピリデン-β-D-プシコフラノース
[(3aR,4R,6R,6aR)-6-[(ベンゾイルオキシ)メチル]-2,2-ジメチル-4-(プロパン-2-イルオキシ)-テトラヒドロ-2H-フロ[3,4-d][1,3]ジオキソール-4-イル]メチル ベンゾアート
[(3aR,4R,6R,6aR)-6-[(benzoyloxy)methyl]-2,2-dimethyl-4-(propan-2-yloxy)-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]methyl benzoate
Other name (1):
1-O,6-O-Dibenzoyl-2-O-isopropyl-3-O,4-O-isopropylidene-β-D-psicofuranose
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