Ethynylestradiol-3-o-glucuronide

Base Information Edit

Chemical Name:Ethynylestradiol-3-o-glucuronide
CAS No.:60134-76-1
Molecular Formula:C26H32O8
Molecular Weight:472.535
Hs Code.:
UNII:W9MHL6CNMK
Nikkaji Number:J2.732.398G
ChEMBL ID:CHEMBL2074825
Mol file:60134-76-1.mol

Synonyms:60134-76-1;Ethynylestradiol-3-o-glucuronide;UNII-W9MHL6CNMK;W9MHL6CNMK;17alpha-Ethynylestradiol 3-glucuronide;Ethynylestradiol 3--D-Glucuronide;Ethynyl Estradiol 3-?-D-Glucuronide;Ethynyl Estradiol 3-beta-D-Glucuronide;(2S,3S,4S,5R,6S)-6-[[(8R,9S,13S,14S,17R)-17-ethynyl-17-hydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid;beta-D-Glucopyranosiduronic acid, (17alpha)-17-hydroxy-19-norpregna-1,3,5(10)-trien-20-yn-3-yl;CHEMBL2074825;Ethynyl Estradiol 3- beta -D-Glucuronide;17.ALPHA.-ETHYNYLESTRADIOL 3-GLUCURONIDE;Q27292506;3-(beta-D-Glucopyranuronosyloxy)-17alpha-ethynylestra-1,3,5(10)-triene-17-ol;(17alpha)-17-Hydroxy-19-norpregna-1,3,5(10)-trien-20-yn-3-yl beta-D-Glucopyranosiduronic Acid;.BETA.-D-GLUCOPYRANOSIDURONIC ACID, (17.ALPHA.)-17-HYDROXY-19-NORPREGNA-1,3,5(10)-TRIEN-20-YN-3-YL

Suppliers and Price of Ethynylestradiol-3-o-glucuronide

Supply Marketing:Edit

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
EthynylEstradiol3-β-D-Glucuronide
10mg
$ 1695.00

TRC
EthynylEstradiol3-β-D-Glucuronide
5mg
$ 970.00

Cayman Chemical
Ethynyl Estradiol 3-β-D-Glucuronide ≥96%
1mg
$ 321.00

Cayman Chemical
Ethynyl Estradiol 3-β-D-Glucuronide ≥96%
500μg
$ 169.00

Biosynth Carbosynth
Ethynyl estradiol 3-b-D-glucuronide
5 mg
$ 1051.10

Biosynth Carbosynth
Ethynyl estradiol 3-b-D-glucuronide
2 mg
$ 578.10

American Custom Chemicals Corporation
ETHYNYL ESTRADIOL-3-GLUCURONIDE 95.00%
10MG
$ 2194.50

American Custom Chemicals Corporation
ETHYNYL ESTRADIOL-3-GLUCURONIDE 95.00%
1MG
$ 779.63

Total 8 raw suppliers

Chemical Property of Ethynylestradiol-3-o-glucuronide Edit

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Melting Point:161-163°C
Refractive Index:1.657
Boiling Point:705.782°C at 760 mmHg
PKA:2.80±0.70(Predicted)
Flash Point:238.839°C
PSA：145.91000
Density:1.448g/cm³
LogP:1.30070
Storage Temp.:-20°C Freezer
Solubility.:DMSO (Slightly), Methanol (Slightly)
XLogP3:2.1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:472.20971797
Heavy Atom Count:34
Complexity:853

Purity/Quality:

95% ^*data from raw suppliers

EthynylEstradiol3-β-D-Glucuronide ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)OC5C(C(C(C(O5)C(=O)O)O)O)O
Isomeric SMILES:C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O
Uses A metabolite of Ethynylestradiol.

Technology Process of Ethynylestradiol-3-o-glucuronide

There total 2 articles about Ethynylestradiol-3-o-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: