N-methyl anacycline
AlkaPlorer ID: AK003744
Synonym: 'Tetradeca-2E,4E-diene-8,10-diynoic acid N-methyl isobutylamide', '(2E,4E)-N-methyl-N-(2-methylpropyl)tetradeca-2,4-diene-8,10-diynamide'
IUPAC Name: N-methyl-N-(2-methylpropyl)tetradeca-2,4-dien-8,10-diynamide
Structure
SMILES: CCCC#CC#CCCC=CC=CC(=O)N(C)CC(C)C
InChI: InChI=1S/C19H27NO/c1-5-6-7-8-9-10-11-12-13-14-15-16-19(21)20(4)17-18(2)3/h13-16,18H,5-6,11-12,17H2,1-4H3
InChIKey: SATTXDQQSMAXRK-UHFFFAOYSA-N
Reference
Polyacetylenverbindungen, 206. Über die Inhaltsstoffe von Anacyclus pyrethrum DC
PubChem CID: 129682164
LOTUS: LTS0212030
COCONUT: CNP0176973
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Anacyclus pyrethrum | Anacyclus | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 285.43100000000004
TPSA？: 20.31
MolLogP？: 3.800300000000002
Number of H-Donors: 0
Number of H-Acceptors: 1
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|