Spilantho

Compound Structure:

Synonyms:

Spilanthol; 25394-57-4 ;Affinin (2E,6Z,8E)-N-(2-methylpropyl)deca-2,6,8-trienamide ;N-Isobutyl-2(E),6(Z),8(E)-decatrienamide

Compound ID:

NMPC-1494

PubChem ID:

Molecular Formula:

C14H23NO

Canonical SMILES:

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

InChIKey:

BXOCHUWSGYYSFW-HVWOQQCMSA-N

About the compound:

Properties:

Chemical and Physical Properties

Property Name	Property Value
Molecular Weight	221.34 g/mol
XLogP3-AA	3.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	7
Exact Mass	221.177964357 g/mol
Monoisotopic Mass	221.177964357 g/mol
Topological Polar Surface Area	29.1Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	262
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	3
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Source:PubChem

Source Species:

Senna occidentalis

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