3-[(3R,4R)-3-ethyl-1-methylpiperidin-4-yl]-1-(6-methoxyquinolin-4-yl)propan-1-one
AlkaPlorer ID: AK257327
Synonym: None
IUPAC Name: 3-[(3R,4R)-3-ethyl-1-methylpiperidin-4-yl]-1-(6-methoxyquinolin-4-yl)propan-1-one
Structure
SMILES: CC[C@H]1CN(C)CC[C@H]1CCC(=O)C1=CC=NC2=CC=C(OC)C=C12
InChI: InChI=1S/C21H28N2O2/c1-4-15-14-23(2)12-10-16(15)5-8-21(24)18-9-11-22-20-7-6-17(25-3)13-19(18)20/h6-7,9,11,13,15-16H,4-5,8,10,12,14H2,1-3H3/t15-,16+/m0/s1
InChIKey: MPRQXZAUJGRFNI-JKSUJKDBSA-N
Reference
Three quinicine derived alkaloids from Guettarda trimera
PubChem CID: 162878611
LOTUS: LTS0215534
SuperNatural Ⅲ: SN0232020-01
NPASS: NPC86901
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Gentianella campestris | Gentianella | Gentianaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Dictyochloris fragrans | Dictyochloris | Dictyochloridaceae | Sphaeropleales | Chlorophyceae | Chlorophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 340.46700000000004
TPSA？: 42.43000000000001
MolLogP？: 4.184200000000003
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|