Grandisine G
AlkaPlorer ID: AK118700
Synonym: ''
IUPAC Name: methyl 2-[(2S,4S)-6-[(8aR)-1,2,3,5,6,8a-hexahydroindolizin-8-yl]-4-methyl-2,3,4,5-tetrahydropyridin-2-yl]acetate
Structure
SMILES: COC(=O)C[C@@H]1C[C@H](C)CC(C2=CCCN3CCC[C@H]23)=N1
InChI: InChI=1S/C17H26N2O2/c1-12-9-13(11-17(20)21-2)18-15(10-12)14-5-3-7-19-8-4-6-16(14)19/h5,12-13,16H,3-4,6-11H2,1-2H3/t12-,13-,16+/m0/s1
InChIKey: FOKUWLHFPJKDKM-HEHGZKQESA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Elaeocarpus angustifolius | Elaeocarpus | Elaeocarpaceae | Oxalidales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 290.407
TPSA？: 41.9
MolLogP？: 2.583500000000001
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|