2,10-Dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-1,9-diol

Base Information

Chemical Name:2,10-Dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-1,9-diol
CAS No.:3019-51-0
Molecular Formula:C₁₉H₂₁NO₄
Molecular Weight:327.38
Hs Code.:
NSC Number:113983
DSSTox Substance ID:DTXSID20863078
Nikkaji Number:J14.552A,J3.170.287I
Wikipedia:Isoteolin
Wikidata:Q105152300
ChEMBL ID:CHEMBL4083068
Mol file:3019-51-0.mol

Synonyms:d-Isoboldine;2,10-Dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-1,9-diol;3019-51-0;5164-93-2;starbld0001242;(.+/-.)-Isoboldine;CHEMBL4083068;SCHEMBL11240744;DTXSID20863078;LINHZVMHXABQLB-UHFFFAOYSA-N;NSC113983;1,9-Dihydroxy-2,10-dimethoxyaporphine;Aporphine, 2,5-dihydroxy-3,6-dimethoxy-;6a.alpha.-Aporphine-1, 2,10-dimethoxy-;FT-0670422;(.+/-.)-1,9-Dihydroxy-2,10-dimethoxyaporphine;Aporphine-1,9-diol, 2,10-dimethoxy-, (.+/-.)-;4H-Dibenzo[de,9-diol, 5,6,6a,7-tetrahydro-2,10-dimethoxy-6-methyl-, (S)-;4H-Dibenzo[de,g]quinoline-1,9-diol, 5,6,6a,7-tetrahydro-2,10-dimethoxy-6-methyl-;4H-Dibenzo[de,g]quinoline-1,9-diol, 5,6,6a,7-tetrahydro-2,10-dimethoxy-6-methyl-, (.+/-.)-

Suppliers and Price of 2,10-Dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-1,9-diol

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
Isoboldine
0.5mg
$ 4125.00

Total 13 raw suppliers

Chemical Property of 2,10-Dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-1,9-diol

Chemical Property:

Vapor Pressure:8.02E-12mmHg at 25°C
Melting Point:180 °C
Boiling Point:814.3°Cat760mmHg
PKA:9.52±0.20(Predicted)
Flash Point:382°C
PSA：62.16000
Density:1.353g/cm³
LogP:2.80500
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:327.14705815
Heavy Atom Count:24
Complexity:461

Purity/Quality:

Analysis control,98.0% ^*data from raw suppliers

Isoboldine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1CCC2=CC(=C(C3=C2C1CC4=CC(=C(C=C43)OC)O)O)OC
Description All aporphine alkaloid occurring in the trunk bark of Nandina domestica and also present in Symplocos celastrina Mart. The alkaloid is dextrorotatory with [0:1b3 + 65.3° (CHCI3). Two methoxyl group, two hydroxyl groups and a methylimino group are present.
Uses A new isoquinoline alkaloid from Litsea cubeba as antibacterial agent. A new isoquinoline alkaloid from Litsea cubeba

Technology Process of 2,10-Dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-1,9-diol

There total 6 articles about 2,10-Dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-1,9-diol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 63.0%

: 475-81-0
glaucine

: 3019-51-0,5164-93-2,13529-67-4,104597-61-7
isoboldine

: 25651-04-1
bracteoline

: 1418137-71-9
11-sulfonyl-1,11-anhydrobracteoline

: 5083-88-5,20068-96-6
thaliporphine

Guidance literature:: With sulfuric acid; In water; at 20 ℃; for 312h;
DOI:10.1021/np3007765

Reference yield: 7.9%

: 485-19-8
(+)-(S)-reticuline

: 3019-51-0,5164-93-2,13529-67-4,104597-61-7
isoboldine

: 25650-75-3
pallidine

: 483-45-4
S-(-)-coreximine

: 605-34-5,6451-72-5,6451-73-6,6507-34-2
(S)-scoulerine

Guidance literature:: With phosphate buffer; (S)-2-[3]pyridyl-pyrrolidine-1-carboxylic acid amide; NADPH; magnesium chloride; at 37 ℃; for 2h; rat liver microsomes;

Reference yield:

: 371196-15-5
N-formyl-laurolitsine

: 3019-51-0,5164-93-2,13529-67-4,104597-61-7
isoboldine

: 25651-04-1
bracteoline

: 1418137-71-9
11-sulfonyl-1,11-anhydrobracteoline

: 5083-88-5,20068-96-6
thaliporphine

Guidance literature:: Multi-step reaction with 3 steps

1: potassium carbonate / methanol / 24 h / 70 °C

2: lithium aluminium tetrahydride / tetrahydrofuran / 2 h / 20 °C / Inert atmosphere; Reflux

3: sulfuric acid / water / 312 h / 20 °C

With lithium aluminium tetrahydride; sulfuric acid; potassium carbonate; In tetrahydrofuran; methanol; water;
DOI:10.1021/np3007765