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1alpha,3beta-二羟基-24-去甲-9,10-断-5,7,10(19)-胆三烯-23-酸

1alpha,3beta-二羟基-24-去甲-9,10-断-5,7,10(19)-胆三烯-23-酸

CAS号：71204-89-2

英文名：calcitroic acid

分子式

C23H34O4

熔点

密度

1.15g/cm3

分子量

374.514

沸点

572.5ºC at 760 mmHg

溶解度

信号词

危险品标志

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化合物简介

Calcitroic acid (1α-hydroxy-23-carboxy-24,25,26,27-tetranorvitamin D3) is a metabolite of 1α,25-dihydroxyvitamin D3 (calcitriol). Its formation is catalyzed by the enzyme calcitriol 24-hydroxylase. Calcitroic acid is soluble in water and excreted in bile.

基本信息

中文名称

1alpha,3beta-二羟基-24-去甲-9,10-断-5,7,10(19)-胆三烯-23-酸

英文名称

calcitroic acid

中文别名

英文别名

3-[(1R,3aS,4E,7aR)-4-{(2E)-2-[(3S,5R)-3,5-Dihydroxy-2-methylenecy clohexylidene]ethylidene}-7a-methyloctahydro-1H-inden-1-yl]butano ic acid (non-preferred name)、Rugulosin,8,8\'-dihydroxy、8,8\'-Dihydroxyrugulosin、Flavomycelin

CAS号

71204-89-2

分子式

C23H34O4

分子量

374.514

精确质量

374.246

PSA

77.76

LOGP

4.2382

编号系统

UNII

F7KIE52YT0

物化性质

密度

1.15g/cm3

沸点

572.5ºC at 760 mmHg

闪点

314.1ºC

折射率

1.568

合成路线

methyl 1α,3β-dihydroxy-9,10-seco-24-norchola-5,7-10(19)-trien-23-oate

methyl 1α,3β-dihydroxy-9,10-seco-24-norchola-5,7-10(19)-trien-23-oate

1alpha,3beta-二羟基-24-去甲-9,10-断-5,7,10(19)-胆三烯-23-酸

1alpha,3beta-二羟基-24-去甲-9,10-断-5,7,10(19)-胆三烯-23-酸

上游原料

共找到21个上游原料 >

1α2α-epoxy-24-norchola-5,7-dien-23-oic acid

1α2α-epoxy-24-norchola-5,7-dien-23-oic acid

methyl 3-acetoxy-24-norchola-1,3,5,7-tetraen-23-oate

methyl 3-acetoxy-24-norchola-1,3,5,7-tetraen-23-oate

(R)-3-{(1R,3aS,7aR)-4-[(R)-2-Methoxy-2-(2-methylene-bicyclo[3.1.0]hex-1-yl)-eth-(E)-ylidene]-7a-methyl-octahydro-inden-1-yl}-butyric acid methyl ester

(R)-3-{(1R,3aS,7aR)-4-[(R)-2-Methoxy-2-(2-methylene-bicyclo[3.1.0]hex-1-yl)-eth-(E)-ylidene]-7a-methyl-octahydro-inden-1-yl}-butyric acid methyl ester

methyl 1α,2α-epoxy-3β-hydroxy-24-norchola-5,7-dien-23-oate

methyl 1α,2α-epoxy-3β-hydroxy-24-norchola-5,7-dien-23-oate

methyl 1α,3β-dihydroxy-24-norchola-5,7-dien-23-oate

methyl 1α,3β-dihydroxy-24-norchola-5,7-dien-23-oate

methyl (R)-3-((2R,2aS,3aR,3bR,3cR,5aR,6R,8aR,8bS,13aS)-2-hydroxy-3b,5a-dimethyl-10,12-dioxo-11-phenyl-2,2a,3a,3b,3c,4,5,5a,6,7,8,8a,11,12-tetradecahydro-1H,10H-8b,13a-ethenoindeno[4,5-c]oxireno[2,3-f][1,2,4]triazolo[1,2-a]cinnolin-6-yl)butanoate

methyl (R)-3-((2R,2aS,3aR,3bR,3cR,5aR,6R,8aR,8bS,13aS)-2-hydroxy-3b,5a-dimethyl-10,12-dioxo-11-phenyl-2,2a,3a,3b,3c,4,5,5a,6,7,8,8a,11,12-tetradecahydro-1H,10H-8b,13a-ethenoindeno[4,5-c]oxireno[2,3-f][1,2,4]triazolo[1,2-a]cinnolin-6-yl)butanoate

上游原料

1α2α-epoxy-24-norchola-5,7-dien-23-oic acid methyl 3-acetoxy-24-norchola-1,3,5,7-tetraen-23-oate (R)-3-{(1R,3aS,7aR)-4-[(R)-2-Methoxy-2-(2-methylene-bicyclo[3.1.0]hex-1-yl)-eth-(E)-ylidene]-7a-methyl-octahydro-inden-1-yl}-butyric acid methyl ester methyl 1α,2α-epoxy-3β-hydroxy-24-norchola-5,7-dien-23-oate methyl 1α,3β-dihydroxy-24-norchola-5,7-dien-23-oate methyl (R)-3-((2R,2aS,3aR,3bR,3cR,5aR,6R,8aR,8bS,13aS)-2-hydroxy-3b,5a-dimethyl-10,12-dioxo-11-phenyl-2,2a,3a,3b,3c,4,5,5a,6,7,8,8a,11,12-tetradecahydro-1H,10H-8b,13a-ethenoindeno[4,5-c]oxireno[2,3-f][1,2,4]triazolo[1,2-a]cinnolin-6-yl)butanoate methyl (R)-3-((1R,3aR,7aR)-4-((Z)-2-((S)-5-hydroxy-2-methylcyclohex-1-en-1-yl)vinyl)-7a-methyl-2,3,3a,6,7,7a-hexahydro-1H-inden-1-yl)butanoate 1α-hydroxy-24-oxavitamin D3 Methyl 3β-Hydroxy-24-nor-9,10-secochola-5,7,10(19)-trien-23-oate methyl (R)-3-((3S,9S,10R,13R,14R,17R)-3-acetoxy-10,13-dimethyl-2,3,4,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)butanoate Methyl 3β-Hydroxy-24-norchola-5,7-dien-23-oate (2S)-2-[(3S,8S,9S,10R,13S,14S,17R)-3-acetyloxy-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]propanoic acid methyl 3β-hydroxy-24-norchola-1,5,7-trien-23-oate methyl (R)-3-((1R,3aS,7aR,E)-4-((Z)-2-((3S,5R)-5-acetoxy-3-hydroxy-2-methylenecyclohexylidene)ethylidene)-7a-methyloctahydro-1H-inden-1-yl)butanoate 1α,3β-dihydroxy-24-norchola-5,7-dien-23-oic acid methyl 1α,3β-dihydroxy-9,10-seco-24-norchola-5,7-10(19)-trien-23-oate methyl (3R)-3-((1R,3aS,7aR,E)-4-((2R)-2-((3S)-3-hydroxy-2-methylenebicyclo[3.1.0]hexan-1-yl)-2-methoxyethylidene)-7a-methyloctahydro-1H-inden-1-yl)butanoate methyl (R)-3-((1R,3aS,7aR,E)-7a-methyl-4-((Z)-2-((S)-2-methylene-5-(tosyloxy)cyclohexylidene)ethylidene)octahydro-1H-inden-1-yl)butanoate methyl (R)-3-((2R,4aR,4bR,6aR,7R,9aR,9bS,14aS)-2-hydroxy-4a,6a-dimethyl-11,13-dioxo-12-phenyl-2,4a,4b,5,6,6a,7,8,9,9a,12,13-dodecahydro-1H,11H-9b,14a-ethenobenzo[c]cyclopenta[h][1,2,4]triazolo[1,2-a]cinnolin-7-yl)butanoate