Capaurine
AlkaPlorer ID: AK016226
Synonym: 'SMR001797734', 'Capaurine', '(-)-Capaurine', 'l-Capaurine', 'MLS002920137'
IUPAC Name: (13aS)-2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-1-ol
Structure
SMILES: COC1=C(OC)C(O)=C2C(=C1)CCN1CC3=C(OC)C(OC)=CC=C3C[C@@H]21
InChI: InChI=1S/C21H25NO5/c1-24-16-6-5-12-9-15-18-13(10-17(25-2)21(27-4)19(18)23)7-8-22(15)11-14(12)20(16)26-3/h5-6,10,15,23H,7-9,11H2,1-4H3/t15-/m0/s1
InChIKey: GSPIMPLJQOCBFY-HNNXBMFYSA-N
Reference
Alkaloids from Anomianthus dulcis
PubChem CID: 94149
CAS: 478-14-8
LOTUS: LTS0275656
SuperNatural Ⅲ: SN0114275-01
NPASS: NPC13916
data_source: manually
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Fibraurea recisa | Fibraurea | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Stephania pierrei | Stephania | Menispermaceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Corydalis pallida | Corydalis | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 371.4330000000001
TPSA？: 60.39
MolLogP？: 3.0821000000000014
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Plasmodium falciparum | Plasmodium falciparum | ED50 | 1910.0 | ng/ml | 10.1021/np50099a005 |
| Plasmodium falciparum | Plasmodium falciparum | ED50 | 4340.0 | ng/ml | 10.1021/np50099a005 |
| None | Unchecked | Ratio ED50 | 5.0 | None | 10.1021/np50099a005 |
| None | Unchecked | Ratio ED50 | 10.0 | None | 10.1021/np50099a005 |