Name: Etonogestrel beta-D-Glucuronide
Brand: TRC
SKU: TRC-E933630

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Product Overview

Product Code

TRC-E933630

Product Format

Neat

Molecular Formula

C28 H36 O8

Molecular Weight

500.581

API Family

Etonogestrel

Product Categories

TRC - Toronto Research Chemicals

Documentation

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Product Information

Analyte Name

Etonogestrel beta-D-Glucuronide

Molecular Formula

C28 H36 O8

Molecular Weight

500.581

Accurate Mass

500.241

SMILES

CC[C@]12CC(=C)[C@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@@H]1CC[C@@]2(O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(=O)O)C#C

InChI

InChI=1S/C28H36O8/c1-4-27-13-14(3)20-17-9-7-16(29)12-15(17)6-8-18(20)19(27)10-11-28(27,5-2)36-26-23(32)21(30)22(31)24(35-26)25(33)34/h2,12,17-24,26,30-32H,3-4,6-11,13H2,1H3,(H,33,34)/t17-,18-,19-,20+,21-,22-,23+,24-,26-,27-,28-/m0/s1

IUPAC

(2S,3S,4S,5R,6S)-6-[[(8S,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-11-methylidene-3-oxo-2,6,7,8,9,10,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

Storage Temperature

+4°C

Shipping Temperature

Dry Pack

Country of Origin

CANADA

Product Format

Neat

API Family

Etonogestrel

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