ST 27:1;O5 (BioDeep_00000636864)

   

Volatile Flavor Compounds


代谢物信息卡片


(3alpha,5beta,7alpha,12alpha,25S)-3,7,12-trihydroxycholestan-26-oic acid

化学式: C27H46O5 (450.3345066)
中文名称:
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: C1C[C@@H](O)C[C@@]2([H])C[C@@H](O)[C@]3([H])[C@@](C[C@H](O)[C@@]4([C@@]([H])([C@@H](CCC(O)C(C)C=O)C)CC[C@@]34[H])C)([H])[C@@]12C
InChI: InChI=1S/C27H46O5/c1-15(5-8-22(30)16(2)14-28)19-6-7-20-25-21(13-24(32)27(19,20)4)26(3)10-9-18(29)11-17(26)12-23(25)31/h14-25,29-32H,5-13H2,1-4H3/t15-,16?,17+,18-,19-,20+,21+,22?,23-,24+,25+,26+,27-/m1/s1

描述信息

同义名列表

33 个代谢物同义名

3beta,5alpha,6beta-Trihydroxycholestan-(25R)26-oic acid; ST 27:1;O5; 3alpha,7alpha,16alpha-Trihydroxy-5beta-cholestan-26-oic acid; 3alpha,7alpha,15alpha-Trihydroxy-5beta-cholestan-26-oic acid; 3alpha,12alpha,24R-Trihydroxy-5beta-cholestan-26-oic acid; 3alpha,12alpha,22S-Trihydroxy-5beta-cholestan-26-oic acid; 3alpha,7beta,12alpha-Trihydroxy-5beta-cholestan-26-oic acid; (25R)-1beta,3alpha,7alpha-trihydroxy-5beta-cholestan-26-oic acid; 3alpha,7alpha,24-trihydroxy-5alpha-cholestan-26-oic acid; (25R)-3alpha,7alpha,24-trihydroxy-5alpha-cholestan-26-oic acid; (25S)-3alpha,7alpha,12alpha-trihydroxy-5alpha-cholestan-26-oic acid; (25R)-3alpha,7alpha,12alpha-trihydroxy-5alpha-cholestan-26-oic acid; 3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-27-al; 3alpha,7alpha,12alpha,24-tetrahydroxy-5beta-cholestan-26-al; (3alpha,5beta,7alpha,12alpha,25S)-3,7,12-trihydroxycholestan-26-oic acid; (25S)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid; (3alpha,5beta,7alpha,12alpha,25R)-3,7,12-trihydroxycholestan-26-oic acid; (25R)-3alpha,7alpha,12alpha-trihydroxy-5beta-cholestan-26-oic acid; 5-Cholestene-3beta,7alpha,12alpha,25,26-pentol; 5-Cholestene-3beta,7alpha,12alpha,24,25-pentol; 3alpha,7alpha,12alpha-Trihydroxy-5alpha-cholestan-26-oic acid; 3beta,7alpha,12alpha-Trihydroxy-5beta-cholestan-26-oic acid; 3alpha,7alpha,24-Trihydroxy-5beta-cholestan-26-oic acid; 3alpha,12alpha,22-Trihydroxy-5beta-cholestan-26-oic acid; 3beta,7alpha,12alpha-Trihydroxy-5alpha-cholestan-26-oic acid; 3Alpha,7Alpha,12Alpha-trihydroxy-5Beta-cholestan-26-oic acid; 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestanoic acid; 3alpha,7alpha,12alpha-trihydroxy-5beta-cholestanoate; 26-nor-24-methyl-5alpha-cholest-22E-en-3beta,4,6alpha,15beta,26-pentol; certonardosterol L; 6-oxo-cholestan-2alpha,3alpha,22R,23R-tetrol; 28-Norcastasterone; 3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestanoate



数据库引用编号

71 个数据库交叉引用编号

分类词条

相关代谢途径

Reactome(7)

BioCyc(0)

PlantCyc(0)

代谢反应

0 个相关的代谢反应过程信息。

Reactome(0)

BioCyc(0)

WikiPathways(0)

Plant Reactome(0)

INOH(0)

PlantCyc(0)

COVID-19 Disease Map(0)

PathBank(0)

PharmGKB(0)

2 个相关的物种来源信息

在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有：

  • PubMed: 来源于PubMed文献库中的文献信息，我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表，这个列表按照代谢物同时出现的文献数量降序排序，取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
  • NCBI Taxonomy: 通过文献数据挖掘，得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序，取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
  • Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
  • Chemical Reaction: 在化学反应过程中，存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。

点击图上的相关代谢物的名称，可以跳转到相关代谢物的信息页面。



文献列表

  • Se-Hwan Joo, Tae-Wuk Kim, Seung-Hyun Son, Woo Sung Lee, Takao Yokota, Seong-Ki Kim. Biosynthesis of a cholesterol-derived brassinosteroid, 28-norcastasterone, in Arabidopsis thaliana. Journal of experimental botany. 2012 Mar; 63(5):1823-33. doi: 10.1093/jxb/err354. [PMID: 22170941]
  • Kenneth D R Setchell, James E Heubi, Kevin E Bove, Nancy C O'Connell, Tracy Brewsaugh, Steven J Steinberg, Ann Moser, Robert H Squires. Liver disease caused by failure to racemize trihydroxycholestanoic acid: gene mutation and effect of bile acid therapy. Gastroenterology. 2003 Jan; 124(1):217-32. doi: 10.1053/gast.2003.50017. [PMID: 12512044]
  • D W Johnson, H J ten Brink, R C Schuit, C Jakobs. Rapid and quantitative analysis of unconjugated C(27) bile acids in plasma and blood samples by tandem mass spectrometry. Journal of lipid research. 2001 Jan; 42(1):9-16. doi: NULL. [PMID: 11160360]
  • S Ferdinandusse, H Overmars, S Denis, H R Waterham, R J Wanders, P Vreken. Plasma analysis of di- and trihydroxycholestanoic acid diastereoisomers in peroxisomal alpha-methylacyl-CoA racemase deficiency. Journal of lipid research. 2001 Jan; 42(1):137-41. doi: 10.1016/s0022-2275(20)32345-2. [PMID: 11160375]
  • S Fujioka, T Noguchi, M Sekimoto, S Takatsuto, S Yoshida. 28-Norcastasterone is biosynthesized from castasterone. Phytochemistry. 2000 Sep; 55(2):97-101. doi: 10.1016/s0031-9422(00)00261-2. [PMID: 11065283]
  • A K Farrants, A Nilsson, J I Pedersen. Human hepatoblastoma cells (HepG2) and rat hepatoma cells are defective in important enzyme activities in the oxidation of the C27 steroid side chain in bile acid formation. Journal of lipid research. 1993 Dec; 34(12):2041-50. doi: . [PMID: 8301225]
  • A K Batta, R Mirchandani, G Salen, S Shefer. Synthesis of 3 alpha, 7 alpha-dihydroxy-5 beta-cholestan-26-oic acid from 3 alpha,7 alpha,12 alpha-trihydroxy-5 beta-cholestan-26-oic acid: configuration in the bile of Alligator mississippiensis. Steroids. 1992 Apr; 57(4):162-6. doi: 10.1016/0039-128x(92)90002-q. [PMID: 1519259]
  • R J Wanders, M Casteels, G P Mannaerts, C W van Roermund, R B Schutgens, V Kozich, J Zeman, J Hyanek. Accumulation and impaired in vivo metabolism of di- and trihydroxycholestanoic acid in two patients. Clinica chimica acta; international journal of clinical chemistry. 1991 Oct; 202(3):123-32. doi: 10.1016/0009-8981(91)90043-c. [PMID: 1839974]
  • J Goto, H Miura, T Nambara. Studies on steroids. CCXXXXV. Determination of 5 beta-cholestanoic acids in human urine by gas chromatography-mass spectrometry with negative ion chemical ionization detection. Journal of chromatography. 1989 Sep; 493(2):245-55. doi: NULL. [PMID: 2584293]
  • P B Lazarow, Y Fujiki, G M Small, P Watkins, H Moser. Presence of the peroxisomal 22-kDa integral membrane protein in the liver of a person lacking recognizable peroxisomes (Zellweger syndrome). Proceedings of the National Academy of Sciences of the United States of America. 1986 Dec; 83(23):9193-6. doi: 10.1073/pnas.83.23.9193. [PMID: 3538019]
  • K Prydz, B F Kase, I Björkhem, J I Pedersen. Formation of chenodeoxycholic acid from 3 alpha, 7 alpha-dihydroxy-5 beta-cholestanoic acid by rat liver peroxisomes. Journal of lipid research. 1986 Jun; 27(6):622-8. doi: ". [PMID: 3746130]
  • A Poulos, M J Whiting. Identification of 3 alpha,7 alpha,12 alpha-trihydroxy-5 beta-cholestan-26-oic acid, an intermediate in cholic acid synthesis, in the plasma of patients with infantile Refsum's disease. Journal of inherited metabolic disease. 1985; 8(1):13-7. doi: 10.1007/bf01805476. [PMID: 2581062]
  • O W Cass, G C Williams, R F Hanson. Competitive inhibition of side chain oxidation of 3 alpha, 7 alpha-dihydroxy-5 beta-cholestan-26-oic acid by 3 alpha, 7 alpha, 12 alpha-trihydroxy-5 beta-cholestan-26-oic acid in the hamster. Journal of lipid research. 1980 Feb; 21(2):186-91. doi: 10.1016/s0022-2275(20)39824-2. [PMID: 7373160]