Name: Soyasaponin II(AS)
Brand: ChromaDex
SKU: CDX-00019337

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Product Overview

Product Code

CDX-00019337

CAS Number

55319-36-3

Product Format

Single Solution

Molecular Formula

C47 H76 O17

Molecular Weight

913.10

Product Categories

Saponins, ChromaDex

Documentation

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Product Information

Analyte Data

Analyte Name

Soyasaponin II

CAS Number

55319-36-3

Molecular Formula

C47 H76 O17

Molecular Weight

913.10

Accurate Mass

912.5083

Melting Point

212-215

Appearance/Form

Powder

Flash Point

-20

Color

White

Odor

Odourless

SMILES

C[C@@H]1O[C@@H](O[C@H]2[C@@H](O)[C@@H](O)CO[C@H]2O[C@@H]3[C@@H](O)[C@H](O)[C@H](O[C@H]3O[C@H]4CC[C@@]5(C)[C@@H](CC[C@]6(C)[C@@H]5CC=C7[C@@H]8CC(C)(C)C[C@@H](O)[C@]8(C)CC[C@@]67C)[C@@]4(C)CO)C(=O)O)[C@H](O)[C@H](O)[C@H]1O

InChI

InChI=1S/C47H76O17/c1-21-29(51)31(53)34(56)39(60-21)63-36-30(52)24(49)19-59-40(36)64-37-33(55)32(54)35(38(57)58)62-41(37)61-28-12-13-44(5)25(45(28,6)20-48)11-14-47(8)26(44)10-9-22-23-17-42(2,3)18-27(50)43(23,4)15-16-46(22,47)7/h9,21,23-37,39-41,48-56H,10-20H2,1-8H3,(H,57,58)/t21-,23-,24-,25+,26+,27+,28-,29-,30-,31+,32-,33-,34+,35-,36-,37+,39-,40-,41+,43+,44-,45+,46+,47+/m0/s1

IUPAC

(2S,3S,4S,5R,6R)-6-[[(3S,4S,4aR,6aR,6bS,8aR,9R,12aS,14aR,14bR)-9-hydroxy-4-(hydroxymethyl)-4,6a,6b,8a,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-5-[(2S,3S,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-3,4-dihydroxy-tetrahydropyran-2-carboxylic acid

Product Data

Storage Temperature

-20°C

Shipping Temperature

Ice pack (-20°C)

Country of Origin

UNITED STATES

Tariff Code

29389090

Product Format

Single Solution

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