Dibenzo(a,g)quinolizinium, 5,6-dihydro-2,3,9,10-tetramethoxy-13-methyl-, chloride (1:1)
Basic information
- CAS
10605-03-5- Standard SMILES
COc1cc2c(cc1OC)-c1c(C)c3ccc(OC)c(OC)c3c[n+]1CC2.[Cl-]- InChIKey
WXOSEFNJXIPZNV-UHFFFAOYSA-M- Molecular formula
- C22H24ClNO4
- Average molar mass
- 401.9 g/mol
- Monoisotopic mass
- 401.1393859
Overview
See also: Dehydrocorydaline (annotation moved to).
Names & identifiers
- Preferred name
- Dibenzo(a,g)quinolizinium, 5,6-dihydro-2,3,9,10-tetramethoxy-13-methyl-, chloride (1:1)
- IUPAC
- 2,3,9,10-tetramethoxy-13-methyl-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium chloride
- English name
- Dehydrocorydaline chloride
- Molecular formula
- C22H24ClNO4
- Molecular weight
- 401.88326
Names & synonyms
10605-03-5RefChem:1083305Dibenzo(a,g)quinolizinium, 5,6-dihydro-2,3,9,10-tetramethoxy-13-methyl-, chloride (1:1)Dehydrocorydaline chlorideDehydrocorydaline (chloride)2,3,9,10-tetramethoxy-13-methyl-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium;chloride2,3,9,10-Tetramethoxy-13-methyl-5,6-dihydroisoquinolino[3,2-a]isoquinolin-7-ium chloride13-Methylpalmatine chlorideDibenzo[a,g]quinolizinium,5,6-dihydro-2,3,9,10-tetramethoxy-13-methyl-NSC 297886Corydaline, dehydro-, chloridePalmatine, 16-methyl-, chloride
Show more names
Dehydrocorydaline chloride, 99.95%Dehydrocorydaline chloride, 10 mM in DMSOinhibit,Bcl-2 Family,Dehydrocorydaline chloride,Autophagy,PARP,poly ADP ribose polymerase,Caspase,13-Methylpalmatine,Dehydrocorydaline,p38 MAPK,Parasite,Inhibitor
Dehydrocorydalinechloride5,6-Dihydro-13-methyl-2,3,9,10-tetramethoxydibenzo(a,g)quinolizinium chloride5,6-Dihydro-2,3,9,10-tetramethoxy-13-methyldibenzo(a,g)quinolizinium chlorideC22H24ClNO4orb1219532orb1309778CHEMBL2270078SCHEMBL28839366
Database identifiers
- CAS
10605-03-5- PubChem CID
- 160950
- DTXSID
DTXSID00909882- ChEMBL
CHEMBL2270078
Properties
Computed structural properties
- Topological polar surface area
- 40.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 503
Physicochemical properties
- Melting point
- 191 · 191-193 °C (decomp)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- 20 mg/ml · DMSO: 20 mg/ml
- form
- A solid
- color
- Light yellow to yellow
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H316
- Precautionary statements
- 501 · P501-P270-P264-P332+P313-P301+P310+P330-P405
- HS Code
- 2933399990 · 2933399990
- Toxicity
- 50 · mouse,LD50,intravenous,9500ug/kg (9.5mg/kg),United States Patent Document. Vol. #3849561,
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933399990
- Toxicity
- mouse,LD50,intravenous,9500ug/kg (9.5mg/kg),United States Patent Document. Vol. #3849561,
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H301-H316
- Precautionary statements
- P501-P270-P264-P332+P313-P301+P310+P330-P405
Chemistry & industry
Applications
UsesDehydrocorydaline chloride (13-Methylpalmatine chloride) is an alkaloid that regulates protein expression of Bax, Bcl-2; activates caspase-7, caspase-8, and inactivates PARP[1]. Dehydrocorydaline chloride elevates p38 MAPK activation. Anti-inflammatory and anti-cancer activities[2]. Dehydrocorydaline chloride shows strong anti-malarial effects (IC50=38 nM), and low cytotoxicity (cell viability>90%) using P. falciparum 3D7 strain[3].
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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