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D9404

洋地黄毒苷配基

Name: 洋地黄毒苷配基
Brand: SIGMA

别名:

3,14,21-三羟基-20(22)-去甲胆烯酸内酯, 3β,14-二羟基-5β,20(22)-卡烯内酯, 5β,20(22)-卡烯内酯-3β,14-二醇

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关于此项目

经验公式（希尔记法）:

C₂₃H₃₄O₄

化学文摘社编号:

143-62-4

分子量:

374.51

UNSPSC Code:

12161900

NACRES:

NA.25

PubChem Substance ID:

24894291

EC Number:

205-603-4

Beilstein/REAXYS Number:

95448

MDL number:

MFCD00003687

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属性

description

non-ionic

assay

≥97.0% (TLC)

form

powder

mol wt

374.51 g/mol

mp

253 °C (lit.)

SMILES string

[H][C@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@]([H])(CC[C@]34O)C5=CC(=O)OC5)[C@@]1(C)CC[C@H](O)C2

InChI

1S/C23H34O4/c1-21-8-5-16(24)12-15(21)3-4-19-18(21)6-9-22(2)17(7-10-23(19,22)26)14-11-20(25)27-13-14/h11,15-19,24,26H,3-10,12-13H2,1-2H3/t15-,16+,17-,18+,19-,21+,22-,23+/m1/s1

InChI key

XZTUSOXSLKTKJQ-CESUGQOBSA-N

Gene Information

rat ... Atp1a1(24211)

说明

General description

Digitoxigenin is the aglycone of digitoxin.

Application

Digitoxigenin has been used in a study to assess its stereochemical effects in cancer cytotoxicity. It has also been used in a study to investigate the advantage of gold(I)-catalyzed glycosidation of glycosyl o-alkyl benzoates to assemble digitoxin.

pictograms

GHS06

signalword

Danger

hcodes

H300

pcodes

P264 - P270 - P301 + P310 - P405 - P501

Hazard Classifications

Acute Tox. 2 Oral

存储类别

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk

WGK 3

ppe

Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges

历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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The crystal structure of digitoxigenin, C23H34O4

Isabella Karle and J. Karle

Acta Crystallographica Section B, Structural Crystallography and Crystal Chemistry, B25, 434-434 (1969)

Cytotoxic principles from the formosan milkweed, Asclepias curassavica.

Michael C Roy et al.

Journal of natural products, 68(10), 1494-1499 (2005-10-29)

A series of cardenolides and related compounds have been isolated from the aerial parts and roots of the ornamental milkweed, Asclepias curassavica. Their structures were determined by spectroscopic and chemical methods. Among them, three derivatives of calactinic acid methyl ester

17 alpha-O-(aminoalkyl)oxime derivatives of 3 beta,14 beta-dihydroxy-5 beta-androstane and 3 beta-hydroxy-14-oxoseco-D-5 beta-androstane as inhibitors of Na(+),K(+)-ATPase at the digitalis receptor.

M Gobbini et al.

Journal of medicinal chemistry, 44(23), 3821-3830 (2001-11-02)

The synthesis and binding affinities to the digitalis Na(+),K(+)-ATPase receptor of a series of 3 beta,14 beta-dihydroxy-5 beta-androstane and 3 beta-hydroxy-14-oxoseco-D-5 beta-androstane derivatives bearing a 17 alpha-(aminoalkoxy)imino chain are reported; some derivatives were also studied for their inotropic activity. Our

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全球贸易项目编号

货号	GTIN
D9404-10MG	04061833590713
D9404-100MG	04061832888538