Chem
J-GLOBAL ID：200907016603034922
Nikkaji number：J1.968.483K
(2S)-3α-(3,4-Dihydroxyphenyl)-7-[(E)-3-methoxy-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-メトキシ-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： C19H20O6
Molecular formula furigana： C19-H20-O6
Molecular weight： 344.363
InChI：
InChI=1S/C19H20O6/c1-23-8-2-3-12-4-7-16-17(9-12)24-18(11-20)19(25-16)13-5-6-14(21)15(22)10-13/h2-7,9-10,18-22H,8,11H2,1H3/b3-2+/t18-,19-/m0/s1
InChI key：
NISIPBVHOHIEJR-XVXNLHAJSA-N
SMILES：
COC/C=C/c1ccc2O[C@H]([C@H](CO)Oc2c1)c1ccc(O)c(O)c1
Systematic name (3)：
- (2S)-3α-(3,4-ジヒドロキシフェニル)-7-[(E)-3-メトキシ-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
- 4-[(2S,3S)-3-(ヒドロキシメチル)-6-[(1E)-3-メトキシプロパ-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-methoxyprop-1-en-1-yl]-2,3-dihydro-1,4-benzodioxin-2-yl]benzene-1,2-diol
- (2S)-3α-(3,4-Dihydroxyphenyl)-7-[(E)-3-methoxy-1-propenyl]-2,3-dihydro-1,4-benzodioxin-2β-methanol
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