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Product Overview

Product Code

TRC-A545040

Product Format

Neat

Molecular Formula

C21 H31 Na O5 S

Molecular Weight

418.523

Product Categories

TRC

Alternate CAS Number

566-61-0

Documentation

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Product Information

Chemical Data

Analyte Name

Allopregnenolone 3 Sulfate Analogue

Molecular Formula

C21 H31 Na O5 S

Molecular Weight

418.523

Accurate Mass

418.179

SMILES

CC(=O)C1=CC[C@H]2[C@@H]3CC[C@H]4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OS(=O)(=O)O[Na]

InChI

InChI=1S/C21H32O5S.Na/c1-13(22)17-6-7-18-16-5-4-14-12-15(26-27(23,24)25)8-10-20(14,2)19(16)9-11-21(17,18)3;/h6,14-16,18-19H,4-5,7-12H2,1-3H3,(H,23,24,25);/q;+1/p-1/t14-,15-,16-,18-,19-,20-,21+;/m0./s1

IUPAC

[(3S,5S,8R,9S,10S,13S,14S)-17-acetyl-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxysulfonyloxysodium

Alternate CAS Number

566-61-0

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Allopregnenolone 3 Sulfate Analogue

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