HEPTADECA-TRANS-2-TRANS-8-TRANS-10-16-TETRAENE-4-6-DIYN-1-AL

Structure

2D structure of HEPTADECA-TRANS-2-TRANS-8-TRANS-10-16-TETRAENE-4-6-DIYN-1-AL
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js.

Names and identifiers

Name

HEPTADECA-TRANS-2-TRANS-8-TRANS-10-16-TETRAENE-4-6-DIYN-1-AL

IUPAC name

(2E,8E,10E)-heptadeca-2,8,10,16-tetraen-4,6-diynal

SMILES

C(\C(=C(\C#CC#C\C(=C(\C=CCCCCC=C)[H])[H])[H])[H])=O

General information

Molecular formula

C17H18O

Molecular weight

238.33 g/mol

Monoisotopic mass

238.1358 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Onopordum acanthium L. subsp. acanthium root -
Bohlmann, F., Kohn, S., Waldau, E. (1966). Polyacetylene compounds. cxiii. polyacetylenes from the subtribe Carduinae. Chem Ber, 99, 3201-3203