(Q105341059)

English

3-[(2E)-3-(Hydroxymethyl)-7-methyl-2,6-octadien-1-yl]-4-hydroxy-trans-cinnamic acid

chemical compound

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Statements

type of chemical entity

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2,6-dimethyloctane monoterpenoid

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biogenic alkylphenol

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316.167459248 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₉H₂₄O₄

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canonical SMILES

O=C(O)C=CC1=CC=C(O)C(=C1)CC=C(CO)CCC=C(C)C

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isomeric SMILES

CC(C)=CCC/C(=C/Cc1cc(/C=C/C(=O)O)ccc1O)CO

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based on heuristic

inferred from InChI

Lorandersonia pulchella

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Geranyl derivatives of p-coumaric acid from Chrysothamnus pulchellus

Identifiers

InChI=1S/C19H24O4/c1-14(2)4-3-5-16(13-20)6-9-17-12-15(7-10-18(17)21)8-11-19(22)23/h4,6-8,10-12,20-21H,3,5,9,13H2,1-2H3,(H,22,23)/b11-8+,16-6-

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XSKMCQAIAGIIAJ-PYIQGEEKSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

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