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Product Overview

Product Code

TRC-D485230

CAS Number

19057-60-4

Product Format

Neat

Molecular Formula

C45 H72 O16

Molecular Weight

869.06

Product Categories

TRC, Oligosaccharides, Phytochemical Reference Materials and Research Tools, Apoptosis, Additional Neuro Products, Stress and Anxiety

Product Type

Bioactive Small Molecule, API

Documentation

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Product Information

Chemical Data

Analyte Name

Dioscin

CAS Number

19057-60-4

Molecular Formula

C45 H72 O16

Molecular Weight

869.06

Accurate Mass

868.482

SMILES

O[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H](O[C@H]3C)[C@@H]([C@H](O)[C@H]3O)O)[C@H](O[C@@H]4CC5=CC[C@@]6([H])[C@@](C7)([H])[C@@](CC[C@]6([H])[C@@]5(C)CC4)(C)[C@]8([H])[C@@]7([H])O[C@@](CC[C@H]9C)(OC9)[C@H]8C)O[C@@H]2CO)O[C@@H](C)[C@H](O)[C@H]1O

InChI

InChI=1S/C45H72O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(60-41-36(52)34(50)32(48)22(4)56-41)37(53)38(29(17-46)58-42)59-40-35(51)33(49)31(47)21(3)55-40/h7,19-22,24-42,46-53H,8-18H2,1-6H3/t19-,20+,21+,22+,24+,25-,26+,27+,28+,29-,30+,31+,32+,33-,34-,35-,36-,37+,38-,39-,40+,41+,42-,43+,44+,45-/m1/s1

IUPAC

(2S,2'S,3R,3'R,4R,4'R,5R,5'R,6S,6'S)-6,6'-(((2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-(((4S,5'R,6aR,6bS,8aS,8bR,9S,10R,11aS,12aS,12bS)-5',6a,8a,9-tetramethyl-1,3,3',4,4',5,5',6,6a,6b,6',7,8,8a,8b,9,11a,12,12a,12b-icosahydrospiro[naphtho[2',1':4,5]indeno[2,1-b]furan-10,2'-pyran]-4-yl)oxy)tetrahydro-2H-pyran-3,5-diyl)bis(oxy))bis(2-methyltetrahydro-2H-pyran-3,4,5-triol)

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API

Product Format

Neat

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