estradiol-3-glucuronide Property

Melting point:

270-275°C

Boiling point:

702.7±60.0 °C(Predicted)

Density 

1.423±0.06 g/cm3(Predicted)

storage temp. 

Hygroscopic, Refrigerator, Under Inert Atmosphere

solubility 

DMSO (Slightly), Methanol (Slightly)

form 

Solid

pka

2.80±0.70(Predicted)

color 

White to Off-White

InChI

InChI=1/C24H32O8/c1-24-9-8-14-13-5-3-12(10-11(13)2-4-15(14)16(24)6-7-17(24)25)31-23-20(28)18(26)19(27)21(32-23)22(29)30/h3,5,10,14-21,23,25-28H,2,4,6-9H2,1H3,(H,29,30)/t14-,15-,16+,17+,18+,19+,20-,21+,23-,24+/s3

InChIKey

MUOHJTRCBBDUOW-GVRVQZKZNA-N

SMILES

[C@@]12([H])CCC3C=C(O[C@H]4[C@H](O)[C@H]([C@H](O)[C@@H](C(=O)O)O4)O)C=CC=3[C@@]1([H])CC[C@]1(C)[C@H](CC[C@@]21[H])O |&1:0,8,9,11,12,14,23,27,29,32,r|

Safety

HS Code 

2938909090

Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Warning

Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P280Wear protective gloves/protective clothing/eye protection/face protection.

P301+P312IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.

estradiol-3-glucuronide Chemical Properties,Usage,Production

Chemical Properties

White Solid

Uses

A metabolite of Estradiol (E888000).

Definition

ChEBI: A steroid glucosiduronic acid that consists of 17beta-estradiol having a beta-glucuronyl residue attached at position 3 via a glycosidic linkage.