Corydamine
AlkaPlorer ID: AK055557
Synonym: None
IUPAC Name: 2-[6-([1,3]dioxolo[4,5-h]isoquinolin-7-yl)-1,3-benzodioxol-5-yl]ethyl-methylazanium
Structure
SMILES: C[NH2+]CCC1=CC2=C(C=C1C1=CC3=CC=C4OCOC4=C3C=N1)OCO2
InChI: InChI=1S/C20H18N2O4/c1-21-5-4-13-7-18-19(25-10-24-18)8-14(13)16-6-12-2-3-17-20(26-11-23-17)15(12)9-22-16/h2-3,6-9,21H,4-5,10-11H2,1H3/p+1
InChIKey: VWHAIQHZMVRBJN-UHFFFAOYSA-O
Reference
The alkaloid compositions ofHypecoum erectum andH. lactiflorum
PubChem CID: 21768982
CAS: 49870-84-0
LOTUS: LTS0167759
SuperNatural Ⅲ: SN0401835
NPASS: NPC74344
COCONUT: CNP0269471
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Corydalis yanhusuo | Corydalis | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Corydalis incisa | Corydalis | Papaveraceae | Ranunculales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 351.3820000000001
TPSA？: 66.42
MolLogP？: 2.0949
Number of H-Donors: 1
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Homo sapiens | BGC-823 | IC50 | 25920.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | HCCLM9 | IC50 | 10020.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | HCT-116 | IC50 | 150000.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | HepG2 | IC50 | 45000.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | HGC-27 | IC50 | 20910.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | HL-60 | IC50 | 112800.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | HT-29 | IC50 | 23000.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | Huh-7 | IC50 | 15510.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | L02 | IC50 | 150000.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | MCF7 | IC50 | 49900.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | MDA-MB-231 | IC50 | 19300.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | RKO | IC50 | 63500.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | SGC-7901 | IC50 | 10620000.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | SK-HEP1 | IC50 | 28190.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | SW480 | IC50 | 25400.0 | nM | 10.1016/j.ejmech.2021.113985 |
| Homo sapiens | U-251 | IC50 | 19100.0 | nM | 10.1016/j.ejmech.2021.113985 |