Trideca-2E,7Z-diene-10,12-diynoic acid isobutylamide
AlkaPlorer ID: AK000575
Synonym: '(2E,7Z)-N-(2-methylpropyl)trideca-2,7-diene-10,12-diynamide'
IUPAC Name: N-(2-methylpropyl)trideca-2,7-dien-10,12-diynamide
Structure
SMILES: C#CC#CCC=CCCCC=CC(O)=NCC(C)C
InChI: InChI=1S/C17H23NO/c1-4-5-6-7-8-9-10-11-12-13-14-17(19)18-15-16(2)3/h1,8-9,13-14,16H,7,10-12,15H2,2-3H3,(H,18,19)
InChIKey: AUFSPNOHXVRCBY-UHFFFAOYSA-N
Reference
Pungent Alkamides from<i>Spilanthes acmella</i>L. var.<i>oleracea</i>Clarke
PubChem CID: 71412111
CAS: 87797-74-8
LOTUS: LTS0138511
COCONUT: CNP0298878
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Echinacea purpurea | Echinacea | Asteraceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 257.37699999999995
TPSA？: 32.59
MolLogP？: 3.9083000000000014
Number of H-Donors: 1
Number of H-Acceptors: 1
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|