Chem
J-GLOBAL ID：201507012885825015   Nikkaji number：J3.378.847I

Myrifralignan C

ミリフラリグナンC
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： C21H26O6
Molecular formula furigana： C21-H26-O6
Molecular weight： 374.433
InChI： InChI=1S/C21H26O6/c1-6-7-14-8-9-16(17(10-14)24-3)27-13(2)20(22)15-11-18(25-4)21(23)19(12-15)26-5/h6-13,20,22-23H,1-5H3/t13-,20-/m0/s1
InChI key： DIEIEAKVQCTJFH-RBZFPXEDSA-N
SMILES： COc1cc(C=CC)ccc1O[C@@H](C)[C@H](O)c1cc(OC)c(O)c(OC)c1
Systematic name  (3)：
  • (1R,2S)-1-(4-ヒドロキシ-3,5-ジメトキシフェニル)-2-[2-メトキシ-4-(1-プロペニル)フェノキシ]プロパン-1-オール
  • 4-[(1R,2S)-1-ヒドロキシ-2-[2-メトキシ-4-(プロパ-1-エン-1-イル)フェノキシ]プロピル]-2,6-ジメトキシフェノール
  • 4-[(1R,2S)-1-hydroxy-2-[2-methoxy-4-(prop-1-en-1-yl)phenoxy]propyl]-2,6-dimethoxyphenol
Other name (3)：
  • (1R,2S)-1-(4-Hydroxy-3,5-dimethoxyphenyl)-2-[2-methoxy-4-(1-propenyl)phenoxy]propane-1-ol
  • ミリフラリグナンC
  • Myrifralignan C
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