Chem
J-GLOBAL ID：201807018463466587   Nikkaji number：J3.722.198H

Maceneolignan K

マセネオリグナンK
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： C24H30O8
Molecular formula furigana： C24-H30-O8
Molecular weight： 446.496
InChI： InChI=1S/C24H30O8/c1-15(23(32-16(2)26)18-9-10-19(27-3)20(14-18)28-4)31-24-21(29-5)12-17(8-7-11-25)13-22(24)30-6/h7-10,12-15,23,25H,11H2,1-6H3/t15-,23-/m0/s1
InChI key： JOKRFZJELSNJNY-WNSKOXEYSA-N
SMILES： COc1ccc(cc1OC)[C@@H](OC(=O)C)[C@H](C)Oc1c(OC)cc(C=CCO)cc1OC
Systematic name  (3)：
  • 3-[4-[(1S,2R)-2-アセトキシ-2-(3,4-ジメトキシフェニル)-1-メチルエトキシ]-3,5-ジメトキシフェニル]アリルアルコール
  • (1R,2S)-1-(3,4-ジメトキシフェニル)-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 アセタート
  • (1R,2S)-1-(3,4-dimethoxyphenyl)-2-[4-(3-hydroxyprop-1-en-1-yl)-2,6-dimethoxyphenoxy]propyl acetate
Other name (3)：
  • 3-[4-[(1S,2R)-2-Acetoxy-2-(3,4-dimethoxyphenyl)-1-methylethoxy]-3,5-dimethoxyphenyl]allyl alcohol
  • マセネオリグナンK
  • Maceneolignan K
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