Aphyllic acid; Me ester
AlkaPlorer ID: AK288943
Synonym: Methyl aphyllate
IUPAC Name: methyl 3-piperidin-2-yl-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine-1-carboxylate
Structure
SMILES: COC(=O)C1CC(C2CCCCN2)CN2CCCCC12
InChI: InChI=1S/C16H28N2O2/c1-20-16(19)13-10-12(14-6-2-4-8-17-14)11-18-9-5-3-7-15(13)18/h12-15,17H,2-11H2,1H3
InChIKey: HEJFXVAYNKJHIP-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Anabasis aphylla | Anabasis | Chenopodiaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 280.412
TPSA？: 41.57
MolLogP？: 1.7920999999999996
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|