Chem
J-GLOBAL ID：200907043249510271   Nikkaji number：J2.215.592J

(1E,4Z,6E)-1-(4-Hydroxy-3-methoxyphenyl)-7-[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]-5-hydroxy-1,4,6-heptatriene-3-one

(1E,4Z,6E)-1-(4-ヒドロキシ-3-メトキシフェニル)-7-[4-(β-D-グルコピラノシルオキシ)-3-メトキシフェニル]-5-ヒドロキシ-1,4,6-ヘプタトリエン-3-オン
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： C27H30O11
Molecular formula furigana： C27-H30-O11
Molecular weight： 530.526
InChI： InChI=1S/C27H30O11/c1-35-21-11-15(5-9-19(21)31)3-7-17(29)13-18(30)8-4-16-6-10-20(22(12-16)36-2)37-27-26(34)25(33)24(32)23(14-28)38-27/h3-13,23-28,30-34H,14H2,1-2H3/b7-3+,8-4+,18-13-/t23-,24-,25+,26-,27-/m1/s1
InChI key： UTULZZKBGPPSOF-JBNJIKQZSA-N
SMILES： COc1cc(/C=C/C(=O)/C=C(\O)/C=C/c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(OC)c2)ccc1O
Systematic name  (3)：
  • (1E,4Z,6E)-1-(4-ヒドロキシ-3-メトキシフェニル)-7-[4-(β-D-グルコピラノシルオキシ)-3-メトキシフェニル]-5-ヒドロキシ-1,4,6-ヘプタトリエン-3-オン
  • (1E,4Z,6E)-5-ヒドロキシ-1-(4-ヒドロキシ-3-メトキシフェニル)-7-(3-メトキシ-4-{[(2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}フェニル)ヘプタ-1,4,6-トリエン-3-オン
  • (1E,4Z,6E)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-7-(3-methoxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)hepta-1,4,6-trien-3-one
Other name (1)：
  • (1E,4Z,6E)-1-(4-Hydroxy-3-methoxyphenyl)-7-[4-(β-D-glucopyranosyloxy)-3-methoxyphenyl]-5-hydroxy-1,4,6-heptatriene-3-one
Thsaurus map：
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