Chem
J-GLOBAL ID：201807009427954029   Nikkaji number：J3.722.202J

Myrislignanometin E

ミリスリグナノメチンE
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： C21H26O7
Molecular formula furigana： C21-H26-O7
Molecular weight： 390.432
InChI： InChI=1S/C21H26O7/c1-13(20(24)15-7-8-16(23)17(12-15)25-2)28-21-18(26-3)10-14(6-5-9-22)11-19(21)27-4/h5-8,10-13,20,22-24H,9H2,1-4H3/t13-,20-/m0/s1
InChI key： QWCGMGGKYDSASC-RBZFPXEDSA-N
SMILES： COc1cc(ccc1O)[C@@H](O)[C@H](C)Oc1c(OC)cc(C=CCO)cc1OC
Systematic name  (3)：
  • (1R,2S)-1-(4-ヒドロキシ-3-メトキシフェニル)-2-[4-(3-ヒドロキシ-1-プロペニル)-2,6-ジメトキシフェノキシ]-1-プロパノール
  • 4-[(1R,2S)-1-ヒドロキシ-2-[4-(3-ヒドロキシプロパ-1-エン-1-イル)-2,6-ジメトキシフェノキシ]プロピル]-2-メトキシフェノール
  • 4-[(1R,2S)-1-hydroxy-2-[4-(3-hydroxyprop-1-en-1-yl)-2,6-dimethoxyphenoxy]propyl]-2-methoxyphenol
Other name (3)：
  • (1R,2S)-1-(4-Hydroxy-3-methoxyphenyl)-2-[4-(3-hydroxy-1-propenyl)-2,6-dimethoxyphenoxy]-1-propanol
  • ミリスリグナノメチンE
  • Myrislignanometin E
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