(2R,7R,9R,9aS)-9-(hydroxymethyl)-7-[(2R)-6-oxopiperidin-2-yl]-octahydro-1H-quinolizin-2-yl 2-phenylacetate
AlkaPlorer ID: AK263307
Synonym: None
IUPAC Name: [(2R,7R,9R,9aS)-9-(hydroxymethyl)-7-[(2R)-6-oxopiperidin-2-yl]-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-2-yl] 2-phenylacetate
Structure
SMILES: O=C(CC1=CC=CC=C1)O[C@@H]1CCN2C[C@H]([C@H]3CCCC(O)=N3)C[C@@H](CO)[C@@H]2C1
InChI: InChI=1S/C23H32N2O4/c26-15-18-12-17(20-7-4-8-22(27)24-20)14-25-10-9-19(13-21(18)25)29-23(28)11-16-5-2-1-3-6-16/h1-3,5-6,17-21,26H,4,7-15H2,(H,24,27)/t17-,18+,19-,20-,21+/m1/s1
InChIKey: SNZVYWPNUDUKMW-XNTOXWQXSA-N
Reference
New quinolizidine alkaloids from cadia purpurea
PubChem CID: 162927582
LOTUS: LTS0154502
SuperNatural Ⅲ: SN0350741-01
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cadia purpurea | Cadia | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 400.5190000000002
TPSA？: 82.36
MolLogP？: 2.742700000000001
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|