Chem
J-GLOBAL ID：200907017383861446   Nikkaji number：J1.186.322A

3-[3-Methyl-4-(3-phenylpropionyloxy)-2-butenyl]-4-hydroxy-5-isopentenyl-trans-cinnamic acid

3-[3-メチル-4-(3-フェニルプロピオニルオキシ)-2-ブテニル]-4-ヒドロキシ-5-イソペンテニル-trans-けい皮酸
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： C28H32O5
Molecular formula furigana： C28-H32-O5
Molecular weight： 448.559
InChI： InChI=1S/C28H32O5/c1-20(2)9-13-24-17-23(11-15-26(29)30)18-25(28(24)32)14-10-21(3)19-33-27(31)16-12-22-7-5-4-6-8-22/h4-11,15,17-18,32H,12-14,16,19H2,1-3H3,(H,29,30)/b15-11+,21-10?
InChI key： KEGGSNBDOKNEDU-FPZJRCEDSA-N
SMILES： CC(=CCc1cc(/C=C/C(=O)O)cc(CC=C(C)COC(=O)CCc2ccccc2)c1O)C
Systematic name  (3)：
  • 3-[3-メチル-4-(3-フェニルプロピオニルオキシ)-2-ブテニル]-4-ヒドロキシ-5-イソペンテニル-trans-けい皮酸
  • (2E)-3-(4-ヒドロキシ-3-{3-メチル-4-[(3-フェニルプロパノイル)オキシ]ブタ-2-エン-1-イル}-5-(3-メチルブタ-2-エン-1-イル)フェニル)プロパ-2-エン酸
  • (2E)-3-(4-hydroxy-3-{3-methyl-4-[(3-phenylpropanoyl)oxy]but-2-en-1-yl}-5-(3-methylbut-2-en-1-yl)phenyl)prop-2-enoic acid
Other name (1)：
  • 3-[3-Methyl-4-(3-phenylpropionyloxy)-2-butenyl]-4-hydroxy-5-isopentenyl-trans-cinnamic acid
Thsaurus map：
Thesaurus Map

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