Chem
J-GLOBAL ID：200907073810682865   Nikkaji number：J2.257.153B

Apteniol D

アプテニオールD
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： C21H24O8
Molecular formula furigana： C21-H24-O8
Molecular weight： 404.415
InChI： InChI=1S/C21H24O8/c1-26-16-10-13(5-8-19(22)23)4-7-15(16)29-21-17(27-2)11-14(6-9-20(24)25)12-18(21)28-3/h4,7,10-12H,5-6,8-9H2,1-3H3,(H,22,23)(H,24,25)
InChI key： YBOIZGBZDGKRLF-UHFFFAOYSA-N
SMILES： COc1cc(CCC(=O)O)ccc1Oc1c(OC)cc(CCC(=O)O)cc1OC
Systematic name  (3)：
  • 3-[3-メトキシ-4-[2,6-ジメトキシ-4-(2-カルボキシエチル)フェノキシ]フェニル]プロパン酸
  • 3-{4-[4-(2-カルボキシエチル)-2,6-ジメトキシフェノキシ]-3-メトキシフェニル}プロパン酸
  • 3-{4-[4-(2-carboxyethyl)-2,6-dimethoxyphenoxy]-3-methoxyphenyl}propanoic acid
Other name (3)：
  • 3-[3-Methoxy-4-[2,6-dimethoxy-4-(2-carboxyethyl)phenoxy]phenyl]propanoic acid
  • アプテニオールD
  • Apteniol D
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