(S)-(-)-Oleracein E
AlkaPlorer ID: AK002725
Synonym: '', 'Trolline'
IUPAC Name: (10bS)-8,9-dihydroxy-2,5,6,10b-tetrahydro-1H-pyrrolo[2,1-a]isoquinolin-3-one
Structure
SMILES: O=C1CC[C@H]2C3=CC(O)=C(O)C=C3CCN12
InChI: InChI=1S/C12H13NO3/c14-10-5-7-3-4-13-9(1-2-12(13)16)8(7)6-11(10)15/h5-6,9,14-15H,1-4H2/t9-/m0/s1
InChIKey: LJIDRFNRDLYHNC-VIFPVBQESA-N
Reference
A Bioactive Alkaloid from the Flowers of Trollius chinensis
PubChem CID: 11160309
CAS: 724706-17-6
LOTUS: LTS0191659
SuperNatural Ⅲ: SN0207054-02
NPASS: NPC101941
data_source: manually
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Portulaca oleracea | Portulaca | Portulacaceae | Caryophyllales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 219.23999999999995
TPSA？: 60.77
MolLogP？: 1.3173999999999997
Number of H-Donors: 2
Number of H-Acceptors: 3
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | Beta-2 adrenergic receptor | Activity | 70.2 | % | 10.1021/acs.jnatprod.7b00762 |
| Mus musculus | RAW264.7 | EC50 | 35400.0 | nM | 10.1021/acs.jnatprod.7b00762 |
| Mus musculus | RAW264.7 | Inhibition | nan | % | 10.1021/acs.jnatprod.7b00762 |