| S-Allylmercapturic acid | Organic compounds | Organic acids and derivatives | Carboxylic acids and derivatives | Amino acids, peptides, and analogues | Details |
| Sulforaphane-glutathione | Organic compounds | Organic acids and derivatives | Carboxylic acids and derivatives | Amino acids, peptides, and analogues | Details |
| Sulforaphane-N-acetyl-cysteine | Organic compounds | Organic acids and derivatives | Carboxylic acids and derivatives | Amino acids, peptides, and analogues | Details |
| Tyrosol glucuronide | Organic compounds | Organic oxygen compounds | Organooxygen compounds | Carbohydrates and carbohydrate conjugates | Details |
| Urolithin a 3-sulfate | Not Available | Not Available | Not Available | Not Available | Details |
| Calcium acetate | Organic compounds | Organic acids and derivatives | Carboxylic acids and derivatives | Carboxylic acids | Details |
| Celecoxib | Organic compounds | Organoheterocyclic compounds | Azoles | Pyrazoles | Details |
| Sumatriptan | Organic compounds | Organoheterocyclic compounds | Indoles and derivatives | Tryptamines and derivatives | Details |
| Clopidogrel | Organic compounds | Organic acids and derivatives | Carboxylic acids and derivatives | Amino acids, peptides, and analogues | Details |
| Tannase | Organic compounds | Organoheterocyclic compounds | Diazanaphthalenes | Naphthyridines | Details |
| Escitalopram | Organic compounds | Benzenoids | Benzene and substituted derivatives | Phenylbutylamines | Details |
| Calusterone | Organic compounds | Lipids and lipid-like molecules | Steroids and steroid derivatives | Androstane steroids | Details |
| 2,4,6-trinitrotoluene | Organic compounds | Benzenoids | Benzene and substituted derivatives | Nitrobenzenes | Details |
| Cyclo-(glycyl-L-prolyl-L-glutamyl) | Not Available | Not Available | Not Available | Not Available | Details |
| (2s)-5-hydroxy-2-(7-hydroxy-2,2-dimethylchromen-6-yl)-8,8-dimethyl-6-(3-methylbut-2-en-1-yl)-2h,3h-pyrano[2,3-f]chromen-4-one | Organic compounds | Phenylpropanoids and polyketides | Flavonoids | Flavans | Details |
| D-Phenyllactic acid | Organic compounds | Phenylpropanoids and polyketides | Phenylpropanoic acids | Not Available | Details |
| (R)-3-Hydroxy-tetradecanoic acid | Organic compounds | Lipids and lipid-like molecules | Fatty Acyls | Fatty acids and conjugates | Details |
| Palmitoylglycine | Organic compounds | Organic acids and derivatives | Carboxylic acids and derivatives | Amino acids, peptides, and analogues | Details |
| 3b,17b-Dihydroxyetiocholane | Organic compounds | Lipids and lipid-like molecules | Steroids and steroid derivatives | Androstane steroids | Details |
| 3b,7a,12a-Trihydroxy-5a-Cholanoic acid | Organic compounds | Lipids and lipid-like molecules | Steroids and steroid derivatives | Bile acids, alcohols and derivatives | Details |
| 3b,17a,21-Trihydroxypregnenone | Organic compounds | Lipids and lipid-like molecules | Steroids and steroid derivatives | Hydroxysteroids | Details |
| 3a,17a-Dihydroxy-5b-androstane | Organic compounds | Lipids and lipid-like molecules | Steroids and steroid derivatives | Androstane steroids | Details |
| 3b,7b,12a-Trihydroxy-5a-Cholanoic acid | Organic compounds | Lipids and lipid-like molecules | Steroids and steroid derivatives | Bile acids, alcohols and derivatives | Details |
| (1r,2s,6s,7s,10r,11s,16s,18s,19r)-19-(acetylperoxy)-6-(furan-3-yl)-2,20-dihydroxy-7,17,17-trimethyl-4,14-dioxo-5,13,21-trioxahexacyclo[17.2.1.0¹,¹⁰.0²,⁷.0¹¹,¹⁶.0¹¹,²⁰]docosan-18-yl acetate | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Triterpenoids | Details |
| 5a-Androstane-3a,17a-diol | Organic compounds | Lipids and lipid-like molecules | Steroids and steroid derivatives | Androstane steroids | Details |
| Na+ | Inorganic compounds | Homogeneous metal compounds | Homogeneous alkali metal compounds | Not Available | Details |
| L-Homocysteine | Organic compounds | Organic acids and derivatives | Carboxylic acids and derivatives | Amino acids, peptides, and analogues | Details |
| N-Acetyl-alpha-neuraminic acid | Organic compounds | Organic oxygen compounds | Organooxygen compounds | Carbohydrates and carbohydrate conjugates | Details |
| Tauroursocholic acid | Organic compounds | Lipids and lipid-like molecules | Steroids and steroid derivatives | Bile acids, alcohols and derivatives | Details |
| [3S-(3R*,3aR*,5R*,6E,10Z,11aS*)]-3a,4,5,8,9,11a-Hexahydro-5-hydroxy-10-(hydroxymethyl)-3,6-dimethylcyclodeca[b]furan-2(3H)-one | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Terpene lactones | Details |
