(7S)-2-[(1S)-1-carboxylato-2-phenylethyl]-4-(dimethoxymethyl)-7-methyl-5H,6H,7H-cyclopenta[c]pyridin-2-ium
AlkaPlorer ID: AK576433
Synonym: None
IUPAC Name: 2-[4-(dimethoxymethyl)-7-methyl-6,7-dihydro-5H-cyclopenta[c]pyridin-2-ium-2-yl]-3-phenylpropanoate
Structure
SMILES: COC(OC)C1=C[N+](C(CC2=CC=CC=C2)C(=O)[O-])=CC2=C1CCC2C
InChI: InChI=1S/C21H25NO4/c1-14-9-10-16-17(14)12-22(13-18(16)21(25-2)26-3)19(20(23)24)11-15-7-5-4-6-8-15/h4-8,12-14,19,21H,9-11H2,1-3H3
InChIKey: XYLAPKHOJMCKSR-UHFFFAOYSA-N
Reference
Two Novel Actinidine-Type Monoterpene Alkaloids from Incarvillea delavayi.
PubChem CID: 10713199
LOTUS: LTS0067908
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Incarvillea delavayi | Incarvillea | Bignoniaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 355.4340000000002
TPSA？: 62.47
MolLogP？: 1.8488999999999995
Number of H-Donors: 0
Number of H-Acceptors: 4
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|