(Q104995104)

English

(2E,4E)-heptadeca-2,4,9-trien-6-yn-1-yl acetate

chemical compound

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Statements

type of chemical entity

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biogenic acyclic ester

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288.208930136 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₉H₂₈O₂

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canonical SMILES

O=C(OCC=CC=CC#CCC=CCCCCCCC)C

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isomeric SMILES

CCCCCCCC=CCC#C/C=C/C=C/COC(C)=O

1 reference

based on heuristic

inferred from InChI

Bupleurum longiradiatum

1 reference

Polyacetylenes from Bupleurum longiradiatum

Identifiers

InChI=1S/C19H28O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-19(2)20/h9-10,14-17H,3-8,11,18H2,1-2H3/b10-9?,15-14+,17-16+

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FGWTULMYFMTHTA-IWUHLYOSSA-N

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