Spilanthol, affinin

alkaplorer_id: AK000024

Synonym: '', 'Deca-2E,6Z,8E-trienoic acid isobutylamide', '(2E,6Z,8E)-N-(2-methylpropyl)deca-2,6,8-trienamide', 'Spilanthol'

IUPAC_name: N-(2-methylpropyl)deca-2,6,8-trienamide

Structure

SMILES: CC=CC=CCCC=CC(O)=NCC(C)C

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InChI: InChI=1S/C14H23NO/c1-4-5-6-7-8-9-10-11-14(16)15-12-13(2)3/h4-7,10-11,13H,8-9,12H2,1-3H3,(H,15,16)

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InChIKey: BXOCHUWSGYYSFW-UHFFFAOYSA-N

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Reference

DOI

PubChem ID:530394

Cas ID:25394-57-4

Source

Species Genus Family Order Class Phylum Kingdom Superkingdom
Heliopsis longipes Heliopsis Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae

Properties Information

Molecule Weight: 221.344

TPSA: 32.59

MolLogP: 4.067600000000003

Number of H-Donors: 1

Number of H-Acceptors: 1

RingCount: 0

Activities Information

organism target_name standard_type standard_value standard_units doi

Metabolism Information