Exact Mass: 464.3501558

Exact Mass Matches: 464.3501558

Found 38 metabolites which its exact mass value is equals to given mass value 464.3501558, within given mass tolerance error 0.0002 dalton. Try search metabolite list with more accurate mass tolerance error 4.0E-5 dalton.

Castasterone

(2R,3S,5S,8S,9S,10R,13S,14S,17R)-17-[(2S,3R,4R,5S)-3,4-dihydroxy-5,6-dimethyl-heptan-2-yl]-2,3-dihydroxy-10,13-dimethyl-1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-one

C28H48O5 (464.3501558)


   

2-Deoxybrassinolide

15-(3,4-dihydroxy-5,6-dimethylheptan-2-yl)-5-hydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.0²,⁷.0¹²,¹⁶]octadecan-8-one

C28H48O5 (464.3501558)


2-Deoxybrassinolide is found in green vegetables. 2-Deoxybrassinolide is a constituent of seeds of Apium graveolens (celery) and Pisum sativum (pea). Constituent of seeds of Apium graveolens (celery) and Pisum sativum (pea). 2-Deoxybrassinolide is found in pulses, green vegetables, and common pea.

   

Demissidine

(2R,5R,16S)-15-[(2S,3R,4R,5S)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-5-hydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.0^{2,7}.0^{12,16}]octadecan-8-one

C28H48O5 (464.3501558)


3-epidemissidine belongs to solanidines and derivatives class of compounds. Those are steroids with a structure based on the solanidane skeleton. Solanidane arises from the conversion of a cholestane side-chain into a bicyclic system. 3-epidemissidine is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). 3-epidemissidine can be found in alcoholic beverages, potato, and root vegetables, which makes 3-epidemissidine a potential biomarker for the consumption of these food products. 2-deoxybrassinolide belongs to brassinolides and derivatives class of compounds. Those are cholestane based steroid lactones containing benzo[c]indeno[5,4-e]oxepin-3-one. 2-deoxybrassinolide is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 2-deoxybrassinolide can be found in common pea, green vegetables, and pulses, which makes 2-deoxybrassinolide a potential biomarker for the consumption of these food products.

   

Trihydroxycoprostanoic acid

(1S,2R,5R,7R,9R,10R,11S,14R,15R,16S)-5,9,16-trihydroxy-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecane-7-carboxylic acid

C28H48O5 (464.3501558)


Trihydroxycoprostanoic acid is excreted in the urine of patients with Zellweger syndrome (PMID 7347441), a genetic disorder. The oxidation trihydroxycoprostanic acid is deficient in liver homogenates from patients with peroxisomal diseases (PMID 2576087). Trihydroxycoprostanoic acid is found to be associated with adrenoleukodystrophy (ALD), which is also an inborn error of metabolism. Trihydroxycoprostanoic acid is excreted in the urine of patients with Zellweger syndrome (PMID 7347441 ) D005765 - Gastrointestinal Agents > D001647 - Bile Acids and Salts D005765 - Gastrointestinal Agents > D002793 - Cholic Acids

   

Castasterone

(1S,2R,4R,5S,7S,10S,11S,14R,15S)-14-[(2S,3R,4R,5R)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-4,5-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-8-one

C28H48O5 (464.3501558)


Castasterone belongs to tetrahydroxy bile acids, alcohols and derivatives class of compounds. Those are prenol lipids structurally characterized by a bile acid or alcohol which bears four hydroxyl groups. Castasterone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Castasterone can be found in a number of food items such as silver linden, common oregano, pili nut, and canola, which makes castasterone a potential biomarker for the consumption of these food products.

   

3,24-Diepicastasterone

(1S,2R,4R,5R,7S,10S,11S,14R,15S)-14-[(2S,3R,4R,5R)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-4,5-dihydroxy-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-8-one

C28H48O5 (464.3501558)


3,24-diepicastasterone belongs to tetrahydroxy bile acids, alcohols and derivatives class of compounds. Those are prenol lipids structurally characterized by a bile acid or alcohol which bears four hydroxyl groups. 3,24-diepicastasterone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 3,24-diepicastasterone can be found in common bean, green bean, and yellow wax bean, which makes 3,24-diepicastasterone a potential biomarker for the consumption of these food products.

   

Certonardosterol C2

Certonardosterol C2

C28H48O5 (464.3501558)


   

Certonardosterol B2

Certonardosterol B2

C28H48O5 (464.3501558)


   

25-Deacetyllobosterol|deacetyllobosterol

25-Deacetyllobosterol|deacetyllobosterol

C28H48O5 (464.3501558)


   

Me ester-Coprocholic acid

3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestan-26-saeuremethylester|3alpha,7alpha,12alpha-Trihydroxy-5beta-cholestansaeure-methylester|Me ester-Coprocholic acid

C28H48O5 (464.3501558)


   

certonardosterol C

certonardosterol C

C28H48O5 (464.3501558)


   
   

24-methylene-cholestan-1beta,3beta,5alpha,6alpha,11alpha-pentol

24-methylene-cholestan-1beta,3beta,5alpha,6alpha,11alpha-pentol

C28H48O5 (464.3501558)


   

Trihydroxybufosterocholanic acid

Trihydroxybufosterocholanic acid

C28H48O5 (464.3501558)


   

(25S)-24-methyl-5alpha-cholest-24(241)-ene-3beta,4beta,6alpha,15beta,26-pentol|certonardosterol B

(25S)-24-methyl-5alpha-cholest-24(241)-ene-3beta,4beta,6alpha,15beta,26-pentol|certonardosterol B

C28H48O5 (464.3501558)


   

24-methylenecholestane-1alpha,3beta,5alpha,6beta,16beta-pentol

24-methylenecholestane-1alpha,3beta,5alpha,6beta,16beta-pentol

C28H48O5 (464.3501558)


   

3α,7α,12α-Trihydroxy-24-methyl-5β-Cholestan-26-oic acid

3α,7α,12α-Trihydroxy-24-methyl-5β-Cholestan-26-oic acid

C28H48O5 (464.3501558)


   

3alpha,7alpha,12alpha-Trihydroxy-24-methyl-5beta-Cholestan-26-oic acid

3alpha,7alpha,12alpha-Trihydroxy-24-methyl-5beta-Cholestan-26-oic acid

C28H48O5 (464.3501558)


   

2-Deoxybrassinolide

15-(3,4-dihydroxy-5,6-dimethylheptan-2-yl)-5-hydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.0^{2,7}.0^{12,16}]octadecan-8-one

C28H48O5 (464.3501558)


   

ST 28:1;O5

(25S)-24-methylene-5alpha-cholestan-3beta,6alpha,8beta,15beta,26-pentol

C28H48O5 (464.3501558)


   

Sinubrassione

3beta,5alpha,6beta,11alpha-tetrahydroxyergost-1-one

C28H48O5 (464.3501558)


   

24-Epicastasterone

24-Epicastasterone

C28H48O5 (464.3501558)


24-Epicastasterone (24-epi-Castasterone), a brassinosteroid, is a nature product that could be isolated from Hydrodictyon reticulatwn[1].

   
   

7-Oxatyphasterol

7-Oxatyphasterol

C28H48O5 (464.3501558)


A brassinosteroid that is brassinolide in which the hydroxy group at position 2 has been replaced by a hydrogen atom.

   
   
   

(1-hydroxy-3-nonanoyloxypropan-2-yl) (7Z,10Z,13Z)-hexadeca-7,10,13-trienoate

(1-hydroxy-3-nonanoyloxypropan-2-yl) (7Z,10Z,13Z)-hexadeca-7,10,13-trienoate

C28H48O5 (464.3501558)


   

(1-heptanoyloxy-3-hydroxypropan-2-yl) (9Z,12Z,15Z)-octadeca-9,12,15-trienoate

(1-heptanoyloxy-3-hydroxypropan-2-yl) (9Z,12Z,15Z)-octadeca-9,12,15-trienoate

C28H48O5 (464.3501558)


   

(1-hydroxy-3-propanoyloxypropan-2-yl) (10Z,13Z,16Z)-docosa-10,13,16-trienoate

(1-hydroxy-3-propanoyloxypropan-2-yl) (10Z,13Z,16Z)-docosa-10,13,16-trienoate

C28H48O5 (464.3501558)


   

(1-hydroxy-3-pentanoyloxypropan-2-yl) (11Z,14Z,17Z)-icosa-11,14,17-trienoate

(1-hydroxy-3-pentanoyloxypropan-2-yl) (11Z,14Z,17Z)-icosa-11,14,17-trienoate

C28H48O5 (464.3501558)


   

3alpha,7alpha,12alpha-Trihydroxycoprostanic acid

3alpha,7alpha,12alpha-Trihydroxycoprostanic acid

C28H48O5 (464.3501558)


D005765 - Gastrointestinal Agents > D001647 - Bile Acids and Salts D005765 - Gastrointestinal Agents > D002793 - Cholic Acids

   

(1r,3as,3bs,5as,7s,8r,9ar,9bs,11as)-1-[(2s,3r,4r,5r)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-7,8-dihydroxy-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-5-one

(1r,3as,3bs,5as,7s,8r,9ar,9bs,11as)-1-[(2s,3r,4r,5r)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-7,8-dihydroxy-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-5-one

C28H48O5 (464.3501558)


   

(1r,3r,3as,3bs,5s,5as,7s,9as,9br,11ar)-1-[(2s,3e,5r,6s)-7-hydroxy-5,6-dimethylhept-3-en-2-yl]-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthrene-3,3b,5,7-tetrol

(1r,3r,3as,3bs,5s,5as,7s,9as,9br,11ar)-1-[(2s,3e,5r,6s)-7-hydroxy-5,6-dimethylhept-3-en-2-yl]-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthrene-3,3b,5,7-tetrol

C28H48O5 (464.3501558)


   

(1r,3as,3br,5as,7s,8r,9ar,9bs,11ar)-1-[(2s,3r,4s,5s)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-7,8-dihydroxy-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-5-one

(1r,3as,3br,5as,7s,8r,9ar,9bs,11ar)-1-[(2s,3r,4s,5s)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-7,8-dihydroxy-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-5-one

C28H48O5 (464.3501558)


   

(1r,3as,3br,5as,7s,8r,9ar,9br,11as)-1-[(2s,3r,4r,5r)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-7,8-dihydroxy-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-5-one

(1r,3as,3br,5as,7s,8r,9ar,9br,11as)-1-[(2s,3r,4r,5r)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-7,8-dihydroxy-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-5-one

C28H48O5 (464.3501558)


   

(1r,3as,3bs,5r,5ar,7s,9r,9as,9bs,10r,11ar)-9a,11a-dimethyl-1-[(2r)-6-methyl-5-methylideneheptan-2-yl]-tetradecahydrocyclopenta[a]phenanthrene-5,5a,7,9,10-pentol

(1r,3as,3bs,5r,5ar,7s,9r,9as,9bs,10r,11ar)-9a,11a-dimethyl-1-[(2r)-6-methyl-5-methylideneheptan-2-yl]-tetradecahydrocyclopenta[a]phenanthrene-5,5a,7,9,10-pentol

C28H48O5 (464.3501558)


   

1-(3,4-dihydroxy-5,6-dimethylheptan-2-yl)-7,8-dihydroxy-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-5-one

1-(3,4-dihydroxy-5,6-dimethylheptan-2-yl)-7,8-dihydroxy-9a,11a-dimethyl-tetradecahydrocyclopenta[a]phenanthren-5-one

C28H48O5 (464.3501558)