Chem
J-GLOBAL ID：200907065182628527
Nikkaji number：J458.756A
(2S)-3α-(3,4-Dihydroxyphenyl)-7-[(E)-3-hydroxy-1-propenyl]-2,3-dihydro-1,4-benzodioxin-2β-methanol
(2S)-3α-(3,4-ジヒドロキシフェニル)-7-[(E)-3-ヒドロキシ-1-プロペニル]-2,3-ジヒドロ-1,4-ベンゾジオキシン-2β-メタノール
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： C18H18O6
Molecular formula furigana： C18-H18-O6
Molecular weight： 330.336
InChI：
InChI=1S/C18H18O6/c19-7-1-2-11-3-6-15-16(8-11)23-17(10-20)18(24-15)12-4-5-13(21)14(22)9-12/h1-6,8-9,17-22H,7,10H2/b2-1+/t17-,18-/m0/s1
InChI key：
NKYXNCKZTCGVJJ-QLJMBOKNSA-N
SMILES：
OC/C=C/c1ccc2O[C@H]([C@H](CO)Oc2c1)c1ccc(O)c(O)c1
Systematic name (4)：
- (2S)-3α-(3,4-ジヒドロキシフェニル)-7-[(E)-3-ヒドロキシ-1-プロペニル]-2,3-ジヒドロ-1,4-ベンゾジオキシン-2β-メタノール
- (2S,3S)-3-(3,4-ジヒドロキシフェニル)-7-[(E)-3-ヒドロキシ-1-プロペニル]-2,3-ジヒドロ-1,4-ベンゾジオキシン-2-メタノール
- 4-[(2S,3S)-3-(ヒドロキシメチル)-6-[(1E)-3-ヒドロキシプロパ-1-エン-1-イル]-2,3-ジヒドロ-1,4-ベンゾジオキシン-2-イル]ベンゼン-1,2-ジオール
- 4-[(2S,3S)-3-(hydroxymethyl)-6-[(1E)-3-hydroxyprop-1-en-1-yl]-2,3-dihydro-1,4-benzodioxin-2-yl]benzene-1,2-diol
- (2S)-3α-(3,4-Dihydroxyphenyl)-7-[(E)-3-hydroxy-1-propenyl]-2,3-dihydro-1,4-benzodioxin-2β-methanol
- (2S,3S)-3-(3,4-Dihydroxyphenyl)-7-[(E)-3-hydroxy-1-propenyl]-2,3-dihydro-1,4-benzodioxin-2-methanol
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