Ruspolinone; (ξ)-form
AlkaPlorer ID: AK312780
Synonym: None
IUPAC Name: 1-(3,4-dimethoxyphenyl)-2-pyrrolidin-2-ylethanone
Structure
SMILES: COC1=CC=C(C(=O)CC2CCCN2)C=C1OC
InChI: InChI=1S/C14H19NO3/c1-17-13-6-5-10(8-14(13)18-2)12(16)9-11-4-3-7-15-11/h5-6,8,11,15H,3-4,7,9H2,1-2H3
InChIKey: TYXKSMFICLVQCO-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Ruspolia | Acanthaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 249.31
TPSA？: 47.56
MolLogP？: 2.0286
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|