Chem
J-GLOBAL ID：200907039055619992
Nikkaji number：J863.143C
(E)-3-[[(2R,3S)-2-(3-Methoxy-4-hydroxyphenyl)-3-carboxy-7-methoxy-2,3-dihydrobenzofuran]-5-yl]propenoic acid
(E)-3-[[(2R,3S)-2-(3-メトキシ-4-ヒドロキシフェニル)-3-カルボキシ-7-メトキシ-2,3-ジヒドロベンゾフラン]-5-イル]プロペン酸
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： C20H18O8
Molecular formula furigana： C20-H18-O8
Molecular weight： 386.356
InChI：
InChI=1S/C20H18O8/c1-26-14-9-11(4-5-13(14)21)18-17(20(24)25)12-7-10(3-6-16(22)23)8-15(27-2)19(12)28-18/h3-9,17-18,21H,1-2H3,(H,22,23)(H,24,25)/b6-3+/t17-,18-/m0/s1
InChI key：
JTHPLBUVRLOJBB-ORYMXUJHSA-N
SMILES：
COc1cc(/C=C/C(=O)O)cc2[C@@H]([C@@H](Oc12)c1ccc(O)c(OC)c1)C(=O)O
Systematic name (3)：
- (E)-3-[[(2R,3S)-2-(3-メトキシ-4-ヒドロキシフェニル)-3-カルボキシ-7-メトキシ-2,3-ジヒドロベンゾフラン]-5-イル]プロペン酸
- (2R,3S)-5-[(1E)-2-カルボキシエタ-1-エン-1-イル]-2-(4-ヒドロキシ-3-メトキシフェニル)-7-メトキシ-2,3-ジヒドロ-1-ベンゾフラン-3-カルボン酸
- (2R,3S)-5-[(1E)-2-carboxyeth-1-en-1-yl]-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-carboxylic acid
- (E)-3-[[(2R,3S)-2-(3-Methoxy-4-hydroxyphenyl)-3-carboxy-7-methoxy-2,3-dihydrobenzofuran]-5-yl]propenoic acid
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