641-81-6

• 常用中文名：變膽酸
• 常用英文名：Chol-8(14)-en-24-oicacid, 3,12-dihydroxy-, (3a,5b,12a)
• CAS号：641-81-6
• 分子式：C₂₄H₃₈O₄
• 分子量：390.56
• 相关类别： 研究领域 代谢疾病
• 发布时间：2018-02-12 08:00:00
• 更新时间：2025-08-27 15:48:48
• Apocholic Acid 是一种胆汁酸,是一种内源性代谢物。

名称

• 中文名: 變膽酸
• 英文名: (4R)-4-[(3R,5R,9R,10S,12S,13R,17R)-3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
• 中文别名: 3Α,12Α-二羟基-5Β-胆甾-8烯-24-酸; 去水膽酸; 5Β,8-胆烯-24-酸-3Α,12Α-二醇; 原胆酸; 去水胆酸
• 英文别名: Apocholic acid (ACA); 5-BETA,18-CHOLEN-24-OIC ACID-3-ALPHA,12-ALPHA-DIOL; 3ALPHA,12ALPHA-DIHYDROXY-5BETA-CHOL-8EN-24-OIC ACID; 8, (5β)-CHOLENIC ACID-3α, 12α-DIOL; 3α,12α-dihydroxy-5β,8-cholen-24-oic acid; (4R)-4-[(3R,5R,9R,10S,12S,13R,17R)-3,12-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]valeric acid; 3ALPHA,12ALPHA-DIHYDROXY-5BETA,8-CHOLEN-24-OIC ACID; APOCHOLIC ACID; Apocholic acid/(3α,5β,12α)-3,12-Dihydroxychol-8-en-24-oic acid (ACI)/5β-Chol-8-en-24-oic acid, 3α,12α-dihydroxy- (8CI)/5β-Chol-8-enic acid, 3α,12α-dihydroxy- (6CI, 7CI)/3α,12α-Dihydroxy-5β-chol-8-en-24-oic acid/NSC 18170/NSC; Apocholic acid; 8,5BETA-CHOLENIC-3ALPHA,12ALPHA-DIOL; 3α,12α-Dihydroxy-5β,8-cholen-24-oic acid, 3α,12α-Dihydroxy-5β-chol-8en-24-oic acid, 5β,8-Cholen-24-oic acid-3α,12α-diol; acide apocholique; 3-alpha,12-alpha-dihydroxy-5-beta-chol-8-en-24-oicaci; 3,12-dihydroxy-,(3-alpha,5-beta,12-alpha)-chol-8-en-24-oicaci; 5BETA,8-CHOLEN-24-OIC ACID-3ALPHA,12ALPHA-DIOL; 8, (5-BETA)-CHOLENIC ACID-3-ALPHA, 12-ALPHA-DIOL; Apocholsaeure; alpha-apocholic acid; Chol-8(14)-en-24-oic acid, 3,12-dihydroxy-, (3α,5β,12α); a-apocholic acid; 5β,18-Cholen-24-Oic Acid-3α,12α-Diol; 3α,12α-Dihydroxy-5β-chol-8-en-24-oic acid

物化性质

• 密度: 1.17g/cm3
• 沸点: 560.5ºC at 760 mmHg
• 熔点: 175-176ºC(lit.)
• 分子式: C₂₄H₃₈O₄
• 分子量: 390.56
• 闪点: 306.8ºC
• 精确质量: 390.27700
• PSA: 77.76000
• LogP: 4.54210
• 折射率: 1.567
• 储存条件: 库房通风低温干燥

生物活性

• 描述: Apocholic Acid 是一种胆汁酸,是一种内源性代谢物。
• 相关类别:
  研究领域 >> 代谢疾病
• 参考文献:

  [1]. Liqing He, et al. Metabolic Profiling of Bile Acids in the Urine of Patients with Alcohol-Associated Liver Disease. Hepatol Commun. 2021 Jan 20;5(5):798-811.

毒性和生态

CHEMICAL IDENTIFICATION RTECS NUMBER : FZ5075000 CHEMICAL NAME : 5-beta-Chol-8(14)-en-24-oic acid, 3-alpha,12-alpha-dihydroxy- CAS REGISTRY NUMBER : 641-81-6 BEILSTEIN REFERENCE NO. : 3222755 LAST UPDATED : 199612 DATA ITEMS CITED : 1 MOLECULAR FORMULA : C24-H38-O4 MOLECULAR WEIGHT : 390.62 WISWESSER LINE NOTATION : L E5 B666TJ A1 DQ E1 FY1&2VQ OQ HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : TDLo - Lowest published toxic dose ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 200 mg/kg/13W-I TOXIC EFFECTS : Tumorigenic - equivocal tumorigenic agent by RTECS criteria Tumorigenic - tumors at site of application REFERENCE : NATUAS Nature. (Nature Subscription Dept., POB 1018, Manasguan, NJ 08736) V.1- 1869- Volume(issue)/page/year: 190,1007,1961

安全

• WGK德国: 3
• RTECS号: FZ5075000

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