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1,2,9,10-Tetramethoxy-6-Methyl-5,6,6A,7-Tetrahydro-4H-Dibenzo(De,G)Quinoline

HCID 10145
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
5630-11-5
Standard SMILES
COc1cc2c(cc1OC)-c1c(OC)c(OC)cc3c1C(C2)N(C)CC3
InChIKey
RUZIUYOSRDWYQF-UHFFFAOYSA-N
Molecular formula
C21H25NO4
Average molar mass
355.4 g/mol
Monoisotopic mass
355.17835828

Overview

(±)-glaucine has been reported in Platycapnos tenuiloba, Corydalis ternata, and other organisms with data available.

Names & identifiers

Preferred name
1,2,9,10-Tetramethoxy-6-Methyl-5,6,6A,7-Tetrahydro-4H-Dibenzo(De,G)Quinoline
IUPAC
1,2,9,10-tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline
English name
glaucine
Molecular formula
C21H25NO4
Molecular weight
355.43

Names & synonyms

1,2,9,10-Tetramethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolineDTXSID208593901,2,9,10-Tetramethoxy-6-Methyl-5,6,6A,7-Tetrahydro-4H-Dibenzo(De,G)QuinolineRefChem:1052118DTXCID002044005630-11-52,3,5,6-TetramethoxyaporphineMLS000111916SMR0001078354,5,15,16-tetramethoxy-10-methyl-10-azatetracyclo[7.7.1.0(2),.0(1)(3),(1)]heptadeca-1(16),2,4,6,13(17),14-hexaene4,5,15,16-tetramethoxy-10-methyl-10-azatetracyclo[7.7.1.0(2),?.0(1)(3),(1)?]heptadeca-1(16),2,4,6,13(17),14-hexaeneNSC 34396
Show more names
DL-Glaucine(+/-)-O,O-Dimethylboldine(+/-)-O,O-DimethylisoboldineDL-1,2,9,10-Tetramethoxyaporphine1,2,9,10-Tetramethoxy-6-methylnoraporphine
Glaucine, dlEINECS 227-068-6ChemDiv1_020764O,O-Dimethylisoboldine; S-(+)-Glaucine; NSC 34396Oprea1_671613Oprea1_787880cid_10145CHEMBL36536

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
40.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
26
Formal charge
0
Complexity
489

Physicochemical properties

Melting point
119 ℃ · 119℃
Boiling point
487 · 487.0±45.0 °C(Predicted)
Density
1.166 · 1.166
pka
6.65 · 6.65±0.20(Predicted)

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS ClassificationNot Classified

Hazard information

Hazard Classes and CategoriesNot Classified

Chemistry & industry

Applications

Uses2,3,5,6-Tetramethoxyaporphine is an antitussive agent, a medicinally valuable benzyl isoquinoline alkaloid. 2,3,5,6-Tetramethoxyaporphine can be isolated from the yellow hornpoppy, Glaucium flavum Cr. (Fam. Papaveraceae)[1][2].

Suppliers1 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
5630-11-5
PubChem CID
10145
DTXSID
DTXSID20859390
ChEMBL
CHEMBL36536
EC Number
227-068-6
Nikkaji
J2.325.811K