3,4-Dimethoxyphenethylamine; N-(3,4-Dimethoxy-E-cinnamoyl)
AlkaPlorer ID: AK296551
Synonym: Rubemamine, FEMA 4310
IUPAC Name: (Z)-3-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]prop-2-enamide
Structure
SMILES: COC1=CC=C(/C=C\C(=O)NCCC2=CC=C(OC)C(OC)=C2)C=C1OC
InChI: InChI=1S/C21H25NO5/c1-24-17-8-5-15(13-19(17)26-3)7-10-21(23)22-12-11-16-6-9-18(25-2)20(14-16)27-4/h5-10,13-14H,11-12H2,1-4H3,(H,22,23)/b10-7-
InChIKey: OZNUPWACHHUIKC-YFHOEESVSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Zanthoxylum rubescens | Zanthoxylum | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Chenopodium album | Chenopodium | Chenopodiaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 371.4330000000001
TPSA？: 66.02000000000001
MolLogP？: 3.093100000000001
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|