Isocynometrine; Benzoyl
AlkaPlorer ID: AK302872
Synonym: Isocynodine
IUPAC Name: [[1-methyl-4-(3-methylimidazol-4-yl)-2-oxopyrrolidin-3-yl]-phenylmethyl] benzoate
Structure
SMILES: CN1CC(C2=CN=CN2C)C(C(OC(=O)C2=CC=CC=C2)C2=CC=CC=C2)C1=O
InChI: InChI=1S/C23H23N3O3/c1-25-14-18(19-13-24-15-26(19)2)20(22(25)27)21(16-9-5-3-6-10-16)29-23(28)17-11-7-4-8-12-17/h3-13,15,18,20-21H,14H2,1-2H3
InChIKey: IBZKJMVCDSSXRB-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cynometra lujae | Cynometra | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 389.4550000000001
TPSA？: 64.43
MolLogP？: 3.1902000000000017
Number of H-Donors: 0
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|