| CL(16:0/18:1(11Z)/20:1(11Z)/22:1(13Z)) | Organic compounds | Lipids and lipid-like molecules | Glycerophospholipids | Glycerophosphoglycerophosphoglycerols | Details |
| (3s,6r,10r,13e,16s)-9,12-dihydroxy-10-[(4-methoxyphenyl)methyl]-6-methyl-3-(2-methylpropyl)-16-[(2r,3e)-4-phenylbut-3-en-2-yl]-1,4-dioxa-8,11-diazacyclohexadeca-8,11,13-triene-2,5-dione | Organic compounds | Organic acids and derivatives | Peptidomimetics | Hybrid peptides | Details |
| bis[({[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxy(hydroxy)phosphoryl)oxy]phosphinic acid | Organic compounds | Nucleosides, nucleotides, and analogues | (5'->5')-dinucleotides | Not Available | Details |
| (1s,19s)-19-methoxy-13-azapentacyclo[11.7.0.0¹,¹⁶.0²,⁹.0⁴,⁷]icosa-2,4(7),8,16-tetraene | Organic compounds | Alkaloids and derivatives | Erythrina alkaloids | Homoerythrinane alkaloids | Details |
| 5,7-dihydroxy-6-methyl-4-oxo-2-phenyl-2,3-dihydro-1-benzopyran-8-carbaldehyde | Organic compounds | Phenylpropanoids and polyketides | Flavonoids | Flavans | Details |
| 2-[(4-hydroxy-6-{[4-hydroxy-6-(4-hydroxy-3-methylbutyl)-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-18-en-16-yl]oxy}-2-(hydroxymethyl)-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl)oxy]-6-methyloxane-3,4,5-triol | Organic compounds | Lipids and lipid-like molecules | Steroids and steroid derivatives | Steroidal glycosides | Details |
| (1r,2r,13r,15r)-15-methyl-6-azatetracyclo[8.6.0.0¹,⁶.0²,¹³]hexadeca-7,9-diene-11,12-dione | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Sesquiterpenoids | Details |
| 3-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl 3-(4-hydroxyphenyl)prop-2-enoate | Organic compounds | Phenylpropanoids and polyketides | Cinnamic acids and derivatives | Hydroxycinnamic acids and derivatives | Details |
| 4-[(1e)-2-[(1r,2s)-2-[(1e)-2-(3,4-dimethoxyphenyl)ethenyl]cyclobutyl]ethenyl]-1,2-dimethoxybenzene | Organic compounds | Benzenoids | Benzene and substituted derivatives | Methoxybenzenes | Details |
| (1s,12s,13r,17z,18r)-17-ethylidene-3-methyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8-tetraen-16-one | Organic compounds | Alkaloids and derivatives | Macroline alkaloids | Not Available | Details |
| (3s)-2-acetyl-3-aminobutanedioic acid; indole | Organic compounds | Organic acids and derivatives | Carboxylic acids and derivatives | Amino acids, peptides, and analogues | Details |
| [(1s,7r)-7-hydroxy-hexahydro-1h-pyrrolizin-1-yl]methyl (2z)-2-methylbut-2-enoate | Organic compounds | Organoheterocyclic compounds | Pyrrolizidines | Not Available | Details |
| (2s,3r,4s,5s,6r)-2-{[(1s,4ar,5s,6r,7s,7as)-5,6,7-trihydroxy-7-(hydroxymethyl)-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Terpene glycosides | Details |
| [3,4-dihydroxy-5-({3,4,5-trihydroxy-6-[2-(4-hydroxyphenyl)ethoxy]oxan-2-yl}methoxy)oxolan-3-yl]methyl 4-hydroxybenzoate | Organic compounds | Organic oxygen compounds | Organooxygen compounds | Carbohydrates and carbohydrate conjugates | Details |
| 15-hydroxy-11-methoxy-6,8,20-trioxapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹⁴,¹⁹]icosa-1,9,11,14,16,18-hexaen-13-one | Organic compounds | Phenylpropanoids and polyketides | Sterigmatocystins | Not Available | Details |
| 4-methoxy-5-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trien-1-yl)phenol | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Sesquiterpenoids | Details |
| 1-(2-{[(1r,2r,3s,4s,5r,6s)-2,3,4,5,6-pentahydroxycyclohexyl]oxy}indol-1-yl)ethanone | Not Available | Not Available | Not Available | Not Available | Details |
| (2r,3r,4s,5s,6r)-6-({[(2r,3r,4r,5s,6r)-3,4-dihydroxy-6-(hydroxymethyl)-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}methyl)oxane-2,3,4,5-tetrol | Organic compounds | Organic oxygen compounds | Organooxygen compounds | Carbohydrates and carbohydrate conjugates | Details |
| methyl (3s,4as,12ar)-3-[(5r)-5-hydroxy-2-oxo-5h-furan-3-yl]-4a-methyl-10-methylidene-1-oxo-3h,4h,5h,11h,12h,12ah-cyclodeca[c]pyran-9-carboxylate | Organic compounds | Organic acids and derivatives | Carboxylic acids and derivatives | Tricarboxylic acids and derivatives | Details |
| cyclooctacosane | Organic compounds | Hydrocarbons | Saturated hydrocarbons | Cycloalkanes | Details |
| (1r,2s,3s,7s,8r,9s,12s,13r,14r,15r,16r)-3,8,14,15-tetrahydroxy-2,6,13,16-tetramethyl-10-oxatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadec-5-ene-4,11-dione | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Terpene lactones | Details |
| 6,8-dihydroxy-3,4,5-trimethyl-1-(4-methyl-2-oxopent-3-en-1-yl)-3,4-dihydro-1h-2-benzopyran-7-carboxylic acid | Organic compounds | Benzenoids | Benzene and substituted derivatives | Benzoic acids and derivatives | Details |
| (z)-cinnamoylcocaine | Organic compounds | Phenylpropanoids and polyketides | Cinnamic acids and derivatives | Cinnamic acid esters | Details |
| 1-[(4ar,6r,7as)-2-hydroxy-2-oxo-tetrahydro-4h-2λ⁵-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-4-hydroxy-5-methylpyrimidin-2-one | Organic compounds | Organoheterocyclic compounds | Diazines | Pyrimidines and pyrimidine derivatives | Details |
| 3a,8-dihydroxy-7,9b-dimethyl-3h,5ah,6h,7h,8h,9h,9ah-naphtho[1,2-c]furan-1-one | Organic compounds | Organoheterocyclic compounds | Naphthofurans | Not Available | Details |
| 4-(oct-4-en-1-yl)phenol | Organic compounds | Benzenoids | Phenols | 1-hydroxy-2-unsubstituted benzenoids | Details |
| (1r,5r,7r,8s,18r)-5,7,8-trimethyl-2,10,19-trioxa-15-azatetracyclo[10.5.1.1⁵,⁸.0¹⁵,¹⁸]nonadec-12-ene-3,9-dione | Organic compounds | Phenylpropanoids and polyketides | Macrolides and analogues | Not Available | Details |
| (2r,3s,4s,5s,6r)-6-{[(2s,3s,4s,5s,6s)-6-carboxy-4,5-dihydroxy-2-{[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-7-yl]oxy}oxan-3-yl]oxy}-3,4-dihydroxy-5-{[(2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}oxane-2-carboxylic acid | Organic compounds | Phenylpropanoids and polyketides | Flavonoids | Flavonoid glycosides | Details |
| (2s,3r,4s,5s,6r)-2-{[(2s,3r,4s,5s,6r)-2-{[(2r)-2-[(5e)-hept-5-en-1,3-diyn-1-yl]oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol | Organic compounds | Lipids and lipid-like molecules | Fatty Acyls | Fatty acyl glycosides | Details |
| (1r,3s,4ar,4bs,7r,10ar)-7-ethenyl-1-(hydroxymethyl)-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2h-phenanthren-3-ol | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Diterpenoids | Details |
