Sessilifoline
AlkaPlorer ID: AK037752
Synonym: '', "4beta-Hydroxy-13alpha-O-(2'-pyrrolylcarbonyl)lupanine", 'Digittine', '4beta-Hydroxycalpurnine'
IUPAC Name: [(1R,2S,4S,9R,10R,12S)-12-hydroxy-14-oxo-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-4-yl] 1H-pyrrole-2-carboxylate
Structure
SMILES: O=C(O[C@H]1CCN2C[C@H]3C[C@H](CN4C(=O)C[C@@H](O)C[C@H]34)[C@@H]2C1)C1=CC=CN1
InChI: InChI=1S/C20H27N3O4/c24-14-7-18-12-6-13(11-23(18)19(25)8-14)17-9-15(3-5-22(17)10-12)27-20(26)16-2-1-4-21-16/h1-2,4,12-15,17-18,21,24H,3,5-11H2/t12-,13-,14+,15+,17+,18-/m1/s1
InChIKey: MDJQHHOIXSBKRX-NREAYSRSSA-N
Reference
Two Novel Minor Alkaloids From Ethiopian<i>Calpurnia aurea</i>Ssp.<i>aurea</i>
PubChem CID: 154497457
LOTUS: LTS0269162
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Calpurnia aurea | Calpurnia | Fabaceae | Fabales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 373.4530000000001
TPSA？: 85.87
MolLogP？: 1.0060999999999998
Number of H-Donors: 2
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|