Corlumine
AlkaPlorer ID: AK052130
Synonym: None
IUPAC Name: (6S)-6-[(1S)-6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]-6H-furo[3,4-g][1,3]benzodioxol-8-one
Structure
SMILES: COC1=C(OC)C=C2C(=C1)CCN(C)[C@@H]2[C@H]1OC(=O)C2=C3OCOC3=CC=C21
InChI: InChI=1S/C21H21NO6/c1-22-7-6-11-8-15(24-2)16(25-3)9-13(11)18(22)19-12-4-5-14-20(27-10-26-14)17(12)21(23)28-19/h4-5,8-9,18-19H,6-7,10H2,1-3H3/t18-,19-/m0/s1
InChIKey: SZDGAZFTAUFFQH-OALUTQOASA-N
Reference
Alkaloids from Fumaria judaica
PubChem CID: 442155
CAS: 524-46-9
LOTUS: LTS0045181
SuperNatural Ⅲ: SN0359224-02
NPASS: NPC46744
Source
Properties Information
Molecule Weight: 383.40000000000015
TPSA?: 66.46000000000001
MolLogP?: 2.873200000000001
Number of H-Donors: 0
Number of H-Acceptors: 7
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Cavia porcellus | Ileum | Activity | 0.0 | % | 10.1021/np50028a006 |
| Cavia porcellus | Ileum | Activity | 50.0 | % | 10.1021/np50028a006 |
| Cavia porcellus | Ileum | Activity | nan | None | 10.1021/np50028a006 |
| Cavia porcellus | Ileum | IC50 | 0.5 | ug.mL-1 | 10.1021/np50027a004 |
| Cavia porcellus | Ileum | IC50 | 0.5 | ug.mL-1 | 10.1021/np50028a006 |
| Cavia porcellus | Ileum | Inhibition | 0.0 | % | 10.1021/np50027a004 |
| Cavia porcellus | Ileum | Inhibition | 50.0 | % | 10.1021/np50027a004 |
