(S)-[(3S,4R)-1-methyl-4-(1-methylimidazol-4-yl)-2-oxopyrrolidin-3-yl](phenyl)methyl benzoate
AlkaPlorer ID: AK259265
Synonym: None
IUPAC Name: [(S)-[(3S,4R)-1-methyl-4-(1-methylimidazol-4-yl)-2-oxopyrrolidin-3-yl]-phenylmethyl] benzoate
Structure
SMILES: CN1C[C@H](C2=CN(C)C=N2)[C@@H]([C@H](OC(=O)C2=CC=CC=C2)C2=CC=CC=C2)C1=O
InChI: InChI=1S/C23H23N3O3/c1-25-14-19(24-15-25)18-13-26(2)22(27)20(18)21(16-9-5-3-6-10-16)29-23(28)17-11-7-4-8-12-17/h3-12,14-15,18,20-21H,13H2,1-2H3/t18-,20+,21-/m1/s1
InChIKey: VEEGOOQCXICNQB-HLAWJBBLSA-N
Reference
Imidazole alkaloids from Cynometra hankei
PubChem CID: 163005007
LOTUS: LTS0099904
SuperNatural Ⅲ: SN0387901-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cynometra hankei | 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 |
|---|