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毛地黄毒苷配基

毛地黄毒苷配基

CAS号：143-62-4

英文名：digitoxigenin

分子式

C23H34O4

熔点

253-255°C (dec.)(lit.)

密度

1.231g/cm3

分子量

374.514

沸点

549.3ºC at 760 mmHg

溶解度

信号词

Danger

危险品标志

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化合物简介

Digitoxigenin is cardenolide, obtained especially by hydrolysis of digitoxin (refluxing digitoxin in a mixture of water, alcohol, and hydrochloric acid), which is the aglycon of digitoxin.

基本信息

中文名称

毛地黄毒苷配基

英文名称

digitoxigenin

中文别名

地芰毒配质、毛地黄配质、洋地黄毒苷配基、β-(丁烯酸内酯)-14-羟基甾醇、Β-(丁烯酸内酯)-14-羟基甾醇

英文别名

Digitoxigenin、Card-20(22)-enolide, 3,14-dihydroxy-, (3β,5β)-、DIGITOXIGENIN、3-[(3S,5R,8R,9S,10S,13R,14S,17R)-3,14-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one、3b,14-Dihydroxy-5b-card-20(22)-enolide

CAS号

143-62-4

分子式

C23H34O4

分子量

374.514

精确质量

374.246

PSA

66.76

LOGP

3.6043

编号系统

PubChem号

24894291

MDL号

MFCD00003687

EINECS号

205-603-4

RTECS号

FH4975000

物化性质

密度

1.231g/cm3

沸点

549.3ºC at 760 mmHg

熔点

253-255°C (dec.)(lit.)

闪点

188.1ºC

折射率

1.59

蒸汽压

2.36E-14mmHg at 25°C

安全信息

RTECS号

FH4975000

安全说明

S45

危险类别码

R25

WGK Germany

3

危险品运输编码

UN 3462 6.1/PG 2

危险类别

6.1(a)

包装等级

II

危险品标志

T

危险性描述

H300

危险性防范说明

P264; P301 + P310

信号词

Danger

危险标志

GHS06

生产方法及用途

用途

用于生化研究。

合成路线

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毛花洋地黄苷A

毛花洋地黄苷A

头孢噻肟

毛地黄毒苷配基

毛地黄毒苷配基

上游原料

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(7R,8S)-8-methyl-7-(3-oxopropyl)-1,4-dioxaspiro[4.5]decane-8-carbaldehyde

(7R,8S)-8-methyl-7-(3-oxopropyl)-1,4-dioxaspiro[4.5]decane-8-carbaldehyde

(3S,5R,8R,9S,10S,13R,14S,17R)-3-(tert-Butyl-dimethyl-silanyloxy)-14-hydroxy-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthrene-17-carbaldehyde

(3S,5R,8R,9S,10S,13R,14S,17R)-3-(tert-Butyl-dimethyl-silanyloxy)-14-hydroxy-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthrene-17-carbaldehyde

(3S,5R,8R,9S,10S,13R,14S)-3-((tert-butyldimethylsilyl)oxy)-10,13-dimethyl-17-methylenehexadecahydro-14H-cyclopenta[a]phenanthren-14-ol

(3S,5R,8R,9S,10S,13R,14S)-3-((tert-butyldimethylsilyl)oxy)-10,13-dimethyl-17-methylenehexadecahydro-14H-cyclopenta[a]phenanthren-14-ol

digitoxigen O-[2'',6''-dideoxy-β-D-ribo-hexopyranosyl]-(1->4)-O-[3'-O-acetyl-2',6'-dideoxy-β-D-ribo-hexopyranosyl]-(1->4)-(3-O-acetyl-2,6-dideoxy-β-D-ribo-hexopyranoside

digitoxigen O-[2'',6''-dideoxy-β-D-ribo-hexopyranosyl]-(1->4)-O-[3'-O-acetyl-2',6'-dideoxy-β-D-ribo-hexopyranosyl]-(1->4)-(3-O-acetyl-2,6-dideoxy-β-D-ribo-hexopyranoside

(20RS)-3β-[(tert-butyldimethylsilyl)oxy]-14β-hydroxy-5β,24-norcholane-21,23-dioic acid 14,21-lactone

(20RS)-3β-[(tert-butyldimethylsilyl)oxy]-14β-hydroxy-5β,24-norcholane-21,23-dioic acid 14,21-lactone

(1S,4aS,4bS,7S,8aR,10aR)-1-(but-3-yn-1-yl)-7-((tert-butyldimethylsilyl)oxy)-2,4b-dimethyl-1,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-ol

(1S,4aS,4bS,7S,8aR,10aR)-1-(but-3-yn-1-yl)-7-((tert-butyldimethylsilyl)oxy)-2,4b-dimethyl-1,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-ol

下游产品

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伊夫单甙

芰皂配基

N-cyclopentyl-N-[2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]thiadiazole-4-carboxamide

N-cyclopentyl-N-[2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]thiadiazole-4-carboxamide

地黄苷元

3-epi-17βH-periplogenin

3-epi-17βH-periplogenin

4-[(5R,10S,13R,14S,17R)-14-羟基-10,13-二甲基-3-氧代-2,4,5,6,7,8,9,11,12,15,16,17-十二氢-1H-环戊并[a]菲-17-基]-5H-呋喃-2-酮

4-[(5R,10S,13R,14S,17R)-14-羟基-10,13-二甲基-3-氧代-2,4,5,6,7,8,9,11,12,15,16,17-十二氢-1H-环戊并[a]菲-17-基]-5H-呋喃-2-酮

上游原料

(7R,8S)-8-methyl-7-(3-oxopropyl)-1,4-dioxaspiro[4.5]decane-8-carbaldehyde (3S,5R,8R,9S,10S,13R,14S,17R)-3-(tert-Butyl-dimethyl-silanyloxy)-14-hydroxy-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthrene-17-carbaldehyde (3S,5R,8R,9S,10S,13R,14S)-3-((tert-butyldimethylsilyl)oxy)-10,13-dimethyl-17-methylenehexadecahydro-14H-cyclopenta[a]phenanthren-14-ol digitoxigen O-[2'',6''-dideoxy-β-D-ribo-hexopyranosyl]-(1->4)-O-[3'-O-acetyl-2',6'-dideoxy-β-D-ribo-hexopyranosyl]-(1->4)-(3-O-acetyl-2,6-dideoxy-β-D-ribo-hexopyranoside (20RS)-3β-[(tert-butyldimethylsilyl)oxy]-14β-hydroxy-5β,24-norcholane-21,23-dioic acid 14,21-lactone (1S,4aS,4bS,7S,8aR,10aR)-1-(but-3-yn-1-yl)-7-((tert-butyldimethylsilyl)oxy)-2,4b-dimethyl-1,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-ol (3S,5R,8R,9S,10S,13R,14S,17R)-3-((tert-butyldimethylsilyl)oxy)-14-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthrene-17-carbonitrile [(2R,3R,4S,6S)-3-[(2R,4S,5R,6R)-4-acetyloxy-5-[(2R,4S,5R,6R)-4,5-diacetyloxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-6-[[(3S,5R,8R,9S,10S,13R,17R)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclop Trifluoro-acetic acid (2S,4aS,4bS,7R,8aR,10aR)-4a,7-dimethyl-8-oxo-1,2,3,4,4a,4b,7,8,8a,9,10,10a-dodecahydro-phenanthren-2-yl ester 盐酸 (1S,4aS,4bS,7S,8aR,10aR)-7-((tert-butyldimethylsilyl)oxy)-2,4b-dimethyl-1-(4-(trimethylsilyl)but-3-yn-1-yl)-1,4,4a,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-ol 2-Benzyloxy-1-[(3S,5R,8R,9S,10S,13R,14S,17S)-3-(tert-butyl-dimethyl-silanyloxy)-14-hydroxy-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-17-yl]-ethanone (4aS,7S,8aS)-7-((tert-butyldiphenylsilyl)oxy)-4a-methyl-4a,5,6,7,8,8a-hexahydronaphthalen-2(1H)-one 4-((5R,8R,9S,10S,13R)-3-((tert-butyldimethylsilyl)oxy)-14-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)dihydrofuran-2(3H)-one tert-butyl(((2S,4aS,8aR)-4a-methyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-2-yl)oxy)diphenylsilane (4S,4aR,7S,8aS)-7-((tert-butyldiphenylsilyl)oxy)-4-(2-((1R,2R)-2-(furan-3-yl)-1-methyl-5-oxocyclopentyl)ethyl)-4a-methyloctahydronaphthalen-2(1H)-one 14-hydroxy-3β-tetrahydropyranyloxy-5β-card-20(22)-enolide purpurea glycoside A 毛花洋地黄苷A (3S,5R,8R,9S,10S,13R,14S,17R)-3-((tert-butyldiphenylsilyl)oxy)-17-(furan-3-yl)-10,13-dimethylhexadecahydro-14H-cyclopenta[a]phenanthren-14-ol 洋地黄毒苷 (1S,6R)-8,8-ethylenedioxy-1-methylbicyclo[4.4.0]decan-2-one 奥多诺甙 H (4aS,8aR)-4a-methyl-3,4,4a,7,8,8a-hexahydronaphthalen-2(1H)-one 4-[(3S,5R,8R,9S,10S,13R,17R)-3-[(2R,3R,4R,5S)-3,4-二羟基-5-(羟基甲基)四氢呋喃-2-基]氧基-14-羟基-10,13-二甲基-1,2,3,4,5,6,7,8,9,11,12,15,16,17-十四氢环戊烯并[a]菲-17-基]-5H-呋喃-2-酮 (2R,4aS,4bS,7R,8aR,10aR)-2,4b-dimethyl-4a,4b,5,6,7,8,8a,9,10,10a-decahydro-2H-spiro[phenanthrene-1,2'-[1,3]dithian]-7-ol 3β,14-dihydroxy-17β-(furan-3-yl)-5β,14β-androstane (2R,4aS,4bS,8aR,10aR)-2,4b-dimethyl-4a,5,6,8,8a,9,10,10a-octahydro-2H-spiro[phenanthrene-1,2'-[1,3]dithian]-7(4bH)-one trimethyl(((4aS,8aR)-4a-methyl-3,4,4a,7,8,8a-hexahydro-1H-spiro[naphthalene-2,2'-[1,3]dioxolan]-5-yl)oxy)silane 4-[(3S,5R,8R,9S,10S,13R,14S,17R)-3-(tert-Butyl-dimethyl-silanyloxy)-14-hydroxy-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthren-17-yl]-5H-furan-2-one (4aS,4bS,7S,8aR,10aR)-7-(tert-Butyl-dimethyl-silanyloxy)-2,4b-dimethyl-4a,4b,5,6,7,8,8a,9,10,10a-decahydro-4H-phenanthren-1-one (4aS)-7t-hydroxy-2,4b-dimethyl-(4ar,4bt,8at,10at)-4a,4b,5,6,7,8,8a,9,10,10a-decahydro-4H-phenanthren-1-one (7R,8S)-7-(3-hydroxypropyl)-8-methyl-1,4-dioxaspiro[4.5]decane-8-carbaldehyde 3-((7R,8S)-8-methyl-8-((1E,3E)-penta-1,3-dien-1-yl)-1,4-dioxaspiro[4.5]decan-7-yl)propanal (2'R,4a'S,4b'S,8a'R,10a'R)-2',4b'-dimethyl-4a',4b',5',8',8a',9',10',10a'-octahydro-2'H,6'H-dispiro[[1,3]dioxolane-2,7'-phenanthrene-1',2''-[1,3]dithiane] (2R,4aS,4bS,7S,8aR,10aR)-2,4b-dimethyl-4a,4b,5,6,7,8,8a,9,10,10a-decahydro-2H-spiro[phenanthrene-1,2'-[1,3]dithian]-7-yl 2,2,2-trifluoroacetate 1-((3S,5R,8R,9S,10S,13R,14S,17S)-3-((tert-butyldimethylsilyl)oxy)-14-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-hydroxyethan-1-one (Digitoxigenin-3-yl)-4-O-acetyl-2,3,6-tridesoxy-α-L-erythro-hex-2-enopyranosid 3-[(7R,8S)-8-Methyl-8-((1E,3E)-penta-1,3-dienyl)-1,4-dioxa-spiro[4.5]dec-7-yl]-propan-1-ol (7R,8S)-7-(3-(1,3-dithian-2-ylidene)propyl)-8-methyl-8-((1E,3E)-penta-1,3-dien-1-yl)-1,4-dioxaspiro[4.5]decane (3S,5R,8R,9S,10S,13R,14S,17S)-3-(tert-Butyl-dimethyl-silanyloxy)-14-hydroxy-10,13-dimethyl-hexadecahydro-cyclopenta[a]phenanthrene-17-carbonitrile 3-[(3S,5R,10S,13R,14S,17R)-14-hydroxy-10,13-dimethyl-3-[(2R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]-2H-furan-5-one 夹竹桃苷 (4S,4aR,7S,8aS)-7-((tert-butyldiphenylsilyl)oxy)-4-(2-((6R,7R)-7-(furan-3-yl)-6-methyl-1,4-dioxaspiro[4.4]nonan-6-yl)ethyl)-4a-methyloctahydronaphthalen-2(1H)-one (3S,5S,8R,9S,10S,13R,14S,17R)-3-((tert-butyldiphenylsilyl)oxy)-17-(furan-3-yl)-14-hydroxy-10,13-dimethylhexadecahydro-7H-cyclopenta[a]phenanthren-7-one

下游产品

伊夫单甙芰皂配基 N-cyclopentyl-N-[2-(cyclopentylamino)-2-oxo-1-pyridin-4-ylethyl]thiadiazole-4-carboxamide 地黄苷元 3-epi-17βH-periplogenin 4-[(5R,10S,13R,14S,17R)-14-羟基-10,13-二甲基-3-氧代-2,4,5,6,7,8,9,11,12,15,16,17-十二氢-1H-环戊并[a]菲-17-基]-5H-呋喃-2-酮 (Digitoxigenin-3-yl)-4-O-acetyl-2,3,6-tridesoxy-α-L-erythro-hex-2-enopyranosid 14.21-dihydroxy-5β.14β-pregnanedione-(3.20) 1-((5S,8R,9S,10S,13R,14S,17S)-14-hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)ethanone 兰诺地近三-O-乙酰基-D- 葡萄烯糖 (17alpha)-3alpha,14-二羟基-5beta-心甾-20(22)-烯内酯 Gitoxigenin