6-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoate

Base Information

Chemical Name:6-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoate
CAS No.:55869-99-3
Molecular Formula:C17H23NO4
Molecular Weight:305.374
Hs Code.:
European Community (EC) Number:637-239-0
Nikkaji Number:J410.705E
Wikipedia:Anisodamine
Wikidata:Q105312733

Synonyms:6-hydroxyhyoscyamine;anisodamine;anisodamine hydrobromide;racanisodamine

Suppliers and Price of 6-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoate

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

Usbiological
Anisodamine
20mg
$ 349.00

Sigma-Aldrich
Anisodamine ≥98% (HPLC)
50mg
$ 320.00

Sigma-Aldrich
Anisodamine ≥98% (HPLC)
10mg
$ 82.60

Cayman Chemical
Anisodamine ≥98%
1g
$ 116.00

Cayman Chemical
Anisodamine ≥98%
500mg
$ 73.00

Cayman Chemical
Anisodamine ≥98%
250mg
$ 58.00

Cayman Chemical
Anisodamine ≥98%
100mg
$ 29.00

Biorbyt Ltd
anisodamine
100 mg
$ 408.00

Biorbyt Ltd
anisodamine
20 mg
$ 238.00

AvaChem
Anisodamine
100mg
$ 139.00

Total 49 raw suppliers

Chemical Property of 6-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoate

Chemical Property:

Vapor Pressure:6.49E-08mmHg at 25°C
Melting Point:62-63 °C
Refractive Index:1.565
Boiling Point:423.1 °C at 760 mmHg
PKA:14.12±0.10(Predicted)
Flash Point:174.8 °C
PSA：70.00000
Density:1.16g/cm³
LogP:0.83960
Storage Temp.:room temp
Solubility.:H2O: ≥5mg/mL
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:305.16270821
Heavy Atom Count:22
Complexity:396

Purity/Quality:

99.9% ^*data from raw suppliers

Anisodamine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C2CC(CC1C(C2)O)OC(=O)C(CO)C3=CC=CC=C3
Recent ClinicalTrials:FOLFOX Via HAI Plus Intravenous Irinotecan With or Without Bevacizumab Versus Systemic FOLFOXIRI With or Without Bevacizumab in Initially Unresectable RAS-mutated CRLM Patients
Uses 6S-Hydroxyhyoscyamine is a derivative of Hyoscyamine (H674300), a natural compound that has inhibitory activity against cholinesterases.

Technology Process of 6-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoate

There total 27 articles about 6-Hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 3-hydroxy-2-phenylpropanoate 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:

: 51-34-3,138-12-5,64069-63-2,124917-17-5
scopolamine

: 17659-49-3,32671-33-3,76831-52-2,85760-60-7,126371-43-5,134355-54-7,138876-55-8,55869-99-3
(-)-Anisodamine

: 126371-43-5
7b-Hydroxyhyoscyamine

: 101-31-5
Hyoscyamine

Guidance literature:: With hydrogen; nickel; In water; at 20 ℃; for 19h;
DOI:10.1016/0031-9422(89)80374-7

Reference yield:

: 6415-90-3,50700-39-5,306-03-6,4607-53-8
(-)-hyoscyamine hydrobromide

: 17659-49-3,32671-33-3,76831-52-2,85760-60-7,126371-43-5,134355-54-7,138876-55-8,55869-99-3
(-)-Anisodamine

Guidance literature:: With α-ketoglutaric acid; Anisodus tanguticus hyoscyamine 6β-hydroxylase; iron(II) sulfate; In various solvent(s); at 30 ℃; for 2h; pH=7.4; Enzyme kinetics;
DOI:10.1055/s-2005-837825

Reference yield:

: (1R,3S,5S)-8-methyl[6β-²H]-8-azabicyclo[3.2.1]octan-3-ol

: C₁₇H₂₂⁽²⁾HNO₄

: 17659-49-3,32671-33-3,76831-52-2,85760-60-7,126371-43-5,134355-54-7,138876-55-8,55869-99-3
(-)-Anisodamine

Guidance literature:: Multi-step reaction with 3 steps

1: dmap; camphor-10-sulfonic acid; dicyclohexyl-carbodiimide / dichloromethane / 72 h / 20 °C

2: hydrogenchloride; water / methanol / 20 °C

3: hyoscyamine 6β-hydroxylase; iron(II) sulfate; α-ketoglutaric acid; sodium L-ascorbate / aq. buffer / 0.5 h / 20 °C / pH 6.9 / Enzymatic reaction

With hydrogenchloride; dmap; α-ketoglutaric acid; camphor-10-sulfonic acid; hyoscyamine 6β-hydroxylase; water; iron(II) sulfate; sodium L-ascorbate; dicyclohexyl-carbodiimide; In methanol; dichloromethane;
DOI:10.1021/jacs.8b11585