Chem
J-GLOBAL ID:200907098964038678
Nikkaji number:J1.697.363G
(3R,4R)-3,4-Bis(1,3-benzodioxole-5-yl)hexane-1,6-diol
(3R,4R)-3,4-ビス(1,3-ベンゾジオキソール-5-イル)ヘキサン-1,6-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:
C20 H22 O6
Molecular formula furigana:
C20-H22-O6
Molecular weight:
358.390
InChI:
InChI=1S/C20H22O6/c21-7-5-15(13-1-3-17-19(9-13)25-11-23-17)16(6-8-22)14-2-4-18-20(10-14)26-12-24-18/h1-4,9-10,15-16,21-22H,5-8,11-12H2/t15-,16-/m0/s1
InChI key:
YGPUOVYTIFXITD-HOTGVXAUSA-N
SMILES:
OCC[C@H]([C@@H](CCO)c1ccc2OCOc2c1)c1ccc2OCOc2c1
Systematic name (3):
(3R,4R)-3,4-ビス(1,3-ベンゾジオキソール-5-イル)ヘキサン-1,6-ジオール
(3R,4R)-3,4-ビス(2H-1,3-ベンゾジオキソール-5-イル)ヘキサン-1,6-ジオール
(3R,4R)-3,4-bis(2H-1,3-benzodioxol-5-yl)hexane-1,6-diol
Other name (1):
(3R,4R)-3,4-Bis(1,3-benzodioxole-5-yl)hexane-1,6-diol
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