Chem
J-GLOBAL ID：200907045136953285   Nikkaji number：J2.770.462J

(2S,3S,4R,5E,7E)-2,4,6-Trimethyl-3-(4-methoxybenzyloxy)-8-[(2R,4S,5R)-2-phenyl-5-methyl-1,3-dioxane-4-yl]-5,7-octadiene-1-ol

(2S,3S,4R,5E,7E)-2,4,6-トリメチル-3-(4-メトキシベンジルオキシ)-8-[(2R,4S,5R)-2-フェニル-5-メチル-1,3-ジオキサン-4-イル]-5,7-オクタジエン-1-オール
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： C30H40O5
Molecular formula furigana： C30-H40-O5
Molecular weight： 480.645
InChI： InChI=1S/C30H40O5/c1-21(11-16-28-24(4)19-34-30(35-28)26-9-7-6-8-10-26)17-22(2)29(23(3)18-31)33-20-25-12-14-27(32-5)15-13-25/h6-17,22-24,28-31H,18-20H2,1-5H3/b16-11+,21-17+/t22-,23+,24-,28+,29+,30-/m1/s1
InChI key： XSWYEBJYJCANPK-QVZNTYGQSA-N
SMILES： COc1ccc(CO[C@H]([C@@H](C)CO)[C@H](C)/C=C(\C)/C=C/[C@@H]2O[C@@H](OC[C@H]2C)c2ccccc2)cc1
Systematic name  (3)：
  • (2S,3S,4R,5E,7E)-2,4,6-トリメチル-3-(4-メトキシベンジルオキシ)-8-[(2R,4S,5R)-2-フェニル-5-メチル-1,3-ジオキサン-4-イル]-5,7-オクタジエン-1-オール
  • (2S,3S,4R,5E,7E)-3-[(4-メトキシフェニル)メトキシ]-2,4,6-トリメチル-8-[(2R,4S,5R)-5-メチル-2-フェニル-1,3-ジオキサン-4-イル]オクタ-5,7-ジエン-1-オール
  • (2S,3S,4R,5E,7E)-3-[(4-methoxyphenyl)methoxy]-2,4,6-trimethyl-8-[(2R,4S,5R)-5-methyl-2-phenyl-1,3-dioxan-4-yl]octa-5,7-dien-1-ol
Other name (1)：
  • (2S,3S,4R,5E,7E)-2,4,6-Trimethyl-3-(4-methoxybenzyloxy)-8-[(2R,4S,5R)-2-phenyl-5-methyl-1,3-dioxane-4-yl]-5,7-octadiene-1-ol
Thsaurus map：
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