4beta-hydroxymethyl-4alpha-methyl-5alpha-cholest-7-en-3beta-ol (BioDeep_00000228907)

   

human metabolite


代谢物信息卡片


(1R,2R,5S,6S,7R,11R,14R,15R)-6-(hydroxymethyl)-2,6,15-trimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-9-en-5-ol

化学式: C29H50O2 (430.3811)
中文名称:
谱图信息: 最多检出来源 () 0%

分子结构信息

SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4(C)CO)O)C)C
InChI: InChI=1S/C29H50O2/c1-19(2)8-7-9-20(3)22-11-12-23-21-10-13-25-28(5,24(21)14-16-27(22,23)4)17-15-26(31)29(25,6)18-30/h10,19-20,22-26,30-31H,7-9,11-18H2,1-6H3/t20-,22-,23+,24+,25-,26+,27-,28-,29-/m1/s1

描述信息

4beta-hydroxymethyl-4alpha-methyl-5alpha-cholest-7-en-3beta-ol, also known as 4a-methyl-4b-hydroxymethyl-5a-cholest-7-en-3b-ol, belongs to cholesterols and derivatives class of compounds. Those are compounds containing a 3-hydroxylated cholestane core. Thus, 4beta-hydroxymethyl-4alpha-methyl-5alpha-cholest-7-en-3beta-ol is considered to be a sterol lipid molecule. 4beta-hydroxymethyl-4alpha-methyl-5alpha-cholest-7-en-3beta-ol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 4beta-hydroxymethyl-4alpha-methyl-5alpha-cholest-7-en-3beta-ol can be found in a number of food items such as broad bean, summer savory, hyssop, and alpine sweetvetch, which makes 4beta-hydroxymethyl-4alpha-methyl-5alpha-cholest-7-en-3beta-ol a potential biomarker for the consumption of these food products. 4beta-hydroxymethyl-4alpha-methyl-5alpha-cholest-7-en-3beta-ol may be a unique S.cerevisiae (yeast) metabolite.
4β-hydroxymethyl-4α-methyl-5α-cholest-7-en-3β-ol, also known as 4a-methyl-4b-hydroxymethyl-5a-cholest-7-en-3b-ol, belongs to cholesterols and derivatives class of compounds. Those are compounds containing a 3-hydroxylated cholestane core. Thus, 4β-hydroxymethyl-4α-methyl-5α-cholest-7-en-3β-ol is considered to be a sterol lipid molecule. 4β-hydroxymethyl-4α-methyl-5α-cholest-7-en-3β-ol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 4β-hydroxymethyl-4α-methyl-5α-cholest-7-en-3β-ol can be found in a number of food items such as broad bean, summer savory, hyssop, and alpine sweetvetch, which makes 4β-hydroxymethyl-4α-methyl-5α-cholest-7-en-3β-ol a potential biomarker for the consumption of these food products. 4β-hydroxymethyl-4α-methyl-5α-cholest-7-en-3β-ol may be a unique S.cerevisiae (yeast) metabolite.

同义名列表

9 个代谢物同义名

(1R,2R,5S,6S,7R,11R,14R,15R)-6-(hydroxymethyl)-2,6,15-trimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-9-en-5-ol; 4alpha-methyl-4beta-hydroxymethyl-5alpha-cholest-7-en-3beta-ol; 4beta-Hydroxymethyl-4alpha-methyl-5alpha-cholest-7-en-3beta-ol; 4Β-(hydroxymethyl)-4α-methyl-5α-cholest-7-en-3β-ol; 4b-(Hydroxymethyl)-4a-methyl-5a-cholest-7-en-3b-ol; 4Α-methyl-4β-hydroxymethyl-5α-cholest-7-en-3β-ol; 4b-Hydroxymethyl-4a-methyl-5a-cholest-7-en-3b-ol; 4Β-hydroxymethyl-4α-methyl-5α-cholest-7-en-3β-ol; 4a-Methyl-4b-hydroxymethyl-5a-cholest-7-en-3b-ol



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代谢反应

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1 个相关的物种来源信息

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