Tetrahydrocantleyine; 1-Oxo, O-(3-pyridinecarbonyl)
AlkaPlorer ID: AK315239
Synonym: 6-O-Nicotinoylstrychnovoline
IUPAC Name: methyl 7-methyl-1-oxo-6-(pyridine-3-carbonyloxy)-2,4a,5,6,7,7a-hexahydrocyclopenta[c]pyridine-4-carboxylate
Structure
SMILES: COC(=O)C1=CN=C(O)C2C1CC(OC(=O)C1=CC=CN=C1)C2C
InChI: InChI=1S/C17H18N2O5/c1-9-13(24-16(21)10-4-3-5-18-7-10)6-11-12(17(22)23-2)8-19-15(20)14(9)11/h3-5,7-9,11,13-14H,6H2,1-2H3,(H,19,20)
InChIKey: IRRSEZXMTJDATB-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Scaevola | Goodeniaceae | Asterales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 330.34000000000003
TPSA？: 98.08
MolLogP？: 1.9062
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|