Isobungeanool
AlkaPlorer ID: AK007270
Synonym: '(2E,4E,8Z,11E)-N-(2-hydroxy-2-methylpropyl)tetradeca-2,4,8,11-tetraenamide', 'Tetradeca-2E,4E,8Z,11E-tetraene-acid 2-hydroxy isobutylamide', 'Bungeanool', '(2E,4E,8Z,11Z)-N-(2-hydroxy-2-methylpropyl)tetradeca-2,4,8,11-tetraenamide', 'Tetradeca-2E,4E,8Z,11Z-tetraene-acid 2-hydroxy isobutylamide'
IUPAC Name: N-(2-hydroxy-2-methylpropyl)tetradeca-2,4,8,11-tetraenamide
Structure
SMILES: CCC=CCC=CCCC=CC=CC(O)=NCC(C)(C)O
InChI: InChI=1S/C18H29NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-17(20)19-16-18(2,3)21/h5-6,8-9,12-15,21H,4,7,10-11,16H2,1-3H3,(H,19,20)
InChIKey: HSFPMLIZJAVYHM-UHFFFAOYSA-N
Reference
Isobutylamides from the fruit of Zanthoxylum integrifoliolum
PubChem CID: 53893658
LOTUS: LTS0229803
COCONUT: CNP0242083
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Zanthoxylum bungeanum | Zanthoxylum | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 291.43500000000006
TPSA？: 52.82000000000001
MolLogP？: 4.518900000000005
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 0
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|