Tetrahydrocantleyine; O-(5-Vinyl-3-pyridinecarbonyl)
AlkaPlorer ID: AK315241
Synonym: 6-O-(5-Vinylnicotinoyl)tetrahydrocantleyine
IUPAC Name: methyl 6-(5-ethenylpyridine-3-carbonyl)oxy-7-methyl-2,4a,5,6,7,7a-hexahydro-1H-cyclopenta[c]pyridine-4-carboxylate
Structure
SMILES: C=CC1=CC(C(=O)OC2CC3C(C(=O)OC)=CNCC3C2C)=CN=C1
InChI: InChI=1S/C19H22N2O4/c1-4-12-5-13(8-20-7-12)18(22)25-17-6-14-15(11(17)2)9-21-10-16(14)19(23)24-3/h4-5,7-8,10-11,14-15,17,21H,1,6,9H2,2-3H3
InChIKey: OMSCKIXRVCHVAG-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Scaevola | Goodeniaceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 342.39500000000004
TPSA？: 77.52000000000001
MolLogP？: 2.1823
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|