2-(2-{5-ethenyl-1-azabicyclo[2.2.2]oct-2-en-2-yl}-1H-indol-3-yl)ethyl acetate
AlkaPlorer ID: AK471722
Synonym: None
IUPAC Name: 2-[2-[(4S,5S)-5-ethenyl-1-azabicyclo[2.2.2]oct-2-en-2-yl]-1H-indol-3-yl]ethyl acetate
Structure
SMILES: C=C[C@@H]1CN2CC[C@@H]1C=C2C1=C(CCOC(C)=O)C2=CC=CC=C2N1
InChI: InChI=1S/C21H24N2O2/c1-3-15-13-23-10-8-16(15)12-20(23)21-18(9-11-25-14(2)24)17-6-4-5-7-19(17)22-21/h3-7,12,15-16,22H,1,8-11,13H2,2H3/t15-,16-/m1/s1
InChIKey: NTXQPCRTNMYFJX-HZPDHXFCSA-N
Reference
Five New Alkaloids from the Leaves of <i>Remijia </i><i>p</i><i>eruviana</i>
PubChem CID: 163191092
LOTUS: LTS0019076
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ciliosemina pedunculata | Ciliosemina | Rubiaceae | Gentianales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 336.43499999999995
TPSA？: 45.33
MolLogP？: 3.752100000000002
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|