Toddaliamide
AlkaPlorer ID: AK316138
Synonym: None
IUPAC Name: (E)-N-cyclohexyl-3-[3-(2,3-dihydroxy-3-methylbutyl)-6-hydroxy-2,4-dimethoxyphenyl]prop-2-enamide
Structure
SMILES: COC1=CC(O)=C(/C=C/C(O)=NC2CCCCC2)C(OC)=C1CC(O)C(C)(C)O
InChI: InChI=1S/C22H33NO6/c1-22(2,27)19(25)12-16-18(28-3)13-17(24)15(21(16)29-4)10-11-20(26)23-14-8-6-5-7-9-14/h10-11,13-14,19,24-25,27H,5-9,12H2,1-4H3,(H,23,26)/b11-10+
InChIKey: LPYWPLVBVKPZIA-ZHACJKMWSA-N
Reference
N-cyclohexyl amides and a dimeric coumarin from formosan Toddalia asiatica
PubChem CID: 102066704
CAS: 189295-01-0
LOTUS: LTS0208741
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Toddalia | Rutaceae | Sapindales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 407.5070000000001
TPSA？: 111.74
MolLogP？: 3.386100000000002
Number of H-Donors: 4
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|