Molecule

2,4-Tetradecadienoic acid; (2E,4E)-form, 2-Hydroxy-2-methylpropylamide

AlkaPlorer ID: AK315193

Synonym: N-(2-Hydroxyisobutyl)-2,4-tetradecadienamide, Tetrahydrobungeanool

IUPAC Name: (2E,4E)-N-(2-hydroxy-2-methylpropyl)tetradeca-2,4-dienamide

SMILES: CCCCCCCCC/C=C/C=C/C(O)=NCC(C)(C)O

InChI: InChI=1S/C18H33NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-17(20)19-16-18(2,3)21/h12-15,21H,4-11,16H2,1-3H3,(H,19,20)/b13-12+,15-14+

InChIKey: GJDPGFHVEKFXEZ-SQIWNDBBSA-N

PubChem CID: 5321844

CAS: 200938-43-8

LOTUS: LTS0096543

SuperNatural Ⅲ: SN0107134-01

NPASS: NPC312826

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Zanthoxylum bungeanum	Zanthoxylum	Rutaceae	Sapindales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Zanthoxylum	Rutaceae	Sapindales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Zanthoxylum piperitum	Zanthoxylum	Rutaceae	Sapindales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Zanthoxylum schinifolium	Zanthoxylum	Rutaceae	Sapindales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
None	Zanthoxylum	Rutaceae	Sapindales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 295.46700000000004

TPSA？: 52.82000000000001

MolLogP？: 4.966900000000005

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 0

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Homo sapiens	Cannabinoid CB1 receptor	IC50	4600.0	nM	10.1021/np400478c
Homo sapiens	Cannabinoid CB1 receptor	Inhibition	30.0	%	10.1021/np400478c
Homo sapiens	Cannabinoid CB2 receptor	IC50	2.0	nM	10.1021/np400478c
Homo sapiens	Cannabinoid CB2 receptor	Inhibition	73.0	%	10.1021/np400478c
None	NON-PROTEIN TARGET	Activity	0.0	%	10.1021/np980471n
None	NON-PROTEIN TARGET	Activity	6.7	%	10.1021/np980471n
None	NON-PROTEIN TARGET	Activity	58.3	%	10.1021/np980471n
None	NON-PROTEIN TARGET	Activity	74.0	%	10.1021/np980471n
None	NON-PROTEIN TARGET	Activity	82.7	%	10.1021/np980471n
None	Unchecked	Ratio IC50	2556.0	None	10.1021/np400478c