Etiocholanolone glucuronide

Base Information

Chemical Name:Etiocholanolone glucuronide
CAS No.:3602-09-3
Molecular Formula:C₂₅H₃₈O₈
Molecular Weight:466.572
Hs Code.:
UNII:9LK4DML9R2
DSSTox Substance ID:DTXSID201335941
Nikkaji Number:J1.437.459K
Wikipedia:Etiocholanolone_glucuronide
Wikidata:Q27104404
Metabolomics Workbench ID:36912
Mol file:3602-09-3.mol

Synonyms:(3alpha,5alpha)-17-oxoandrostan-3-yl beta-D-glucopyranosiduronic acid;androsterone glucosiduronate;androsterone glucuronide;androsterone glucuronide, (3beta,5alpha)-isomer;androsterone glucuronide, (beta-D)-isomer;androsterone glucuronide, sodium salt, (3alpha,5alpha)-isomer;androsterone glucuronide, sodium salt, (3alpha,5beta)-isomer;etiocholanolone glucuronide

Suppliers and Price of Etiocholanolone glucuronide

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

American Custom Chemicals Corporation
ETIOCHOLAN-3ALPHA-OL-17-ONE GLUCURONIDE 95.00%
5MG
$ 783.90

Total 4 raw suppliers

Chemical Property of Etiocholanolone glucuronide

Chemical Property:

Vapor Pressure:5.37E-20mmHg at 25°C
Boiling Point:656.1°Cat760mmHg
PKA:2.82±0.70(Predicted)
Flash Point:219.5°C
PSA：133.52000
Density:1.34g/cm³
LogP:1.87560
Storage Temp.:−20°C
XLogP3:2.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:3
Exact Mass:466.25666817
Heavy Atom Count:33
Complexity:801

Purity/Quality:

99% ^*data from raw suppliers

ETIOCHOLAN-3ALPHA-OL-17-ONE GLUCURONIDE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC12CCC(CC1CCC3C2CCC4(C3CCC4=O)C)OC5C(C(C(C(O5)C(=O)O)O)O)O
Isomeric SMILES:C[C@]12CC[C@H](C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CCC4=O)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O

Technology Process of Etiocholanolone glucuronide

There total 8 articles about Etiocholanolone glucuronide 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: 20.0%

: 777038-38-7
α-D-glucuronyl fluoride

: 53-42-9
Etiocholanolone

: 3602-09-3
Etiocholanolone-3-glucuronide

Guidance literature:: With Escherichia coli β-glucuronidase E504G mutant; In aq. phosphate buffer; tert-butyl alcohol; at 37 ℃; for 48h; pH=7.5; Enzymatic reaction;
DOI:10.1039/c4ob00984c