| (2s)-2-[(9z,12z)-octadeca-9,12-dienoyloxy]-3-{[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-({[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}propyl (9z,12z,15z)-octadeca-9,12,15-trienoate | Organic compounds | Lipids and lipid-like molecules | Glycerolipids | Glycosylglycerols | Details |
| methyl (1s,4as,5s,6r,7r,7as)-6-chloro-5,7-dihydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-4-carboxylate | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Terpene glycosides | Details |
| (3r,6r,7s,11r,13s)-11,13-dihydroxy-11-(hydroxymethyl)-3-methyl-6-(prop-1-en-2-yl)-2-oxatricyclo[7.4.0.0³,⁷]tridec-1(9)-en-10-one | Organic compounds | Organic oxygen compounds | Organooxygen compounds | Carbonyl compounds | Details |
| 2,3-dichloro-7-(5,6-dichloro-2,3-dihydro-1h-pyrrolizin-3-yl)-6,8-dihydroxybenzo[a]pyrrolizin-5-one | Organic compounds | Organoheterocyclic compounds | Isoindoles and derivatives | Isoindolines | Details |
| 3-hydroxy-6-{3-hydroxy-4,12-dimethoxy-17-methyl-13-oxo-17-azatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2(7),3,5,11-tetraen-6-yl}-4,12-dimethoxy-17-methyl-17-azatetracyclo[7.5.3.0¹,¹⁰.0²,⁷]heptadeca-2,4,6,11-tetraen-13-one | Organic compounds | Alkaloids and derivatives | Morphinans | Not Available | Details |
| 3,4,5-trihydroxypentan-2-yl 2,4-dihydroxy-6-methylbenzoate | Organic compounds | Benzenoids | Benzene and substituted derivatives | Benzoic acids and derivatives | Details |
| (4s,5s)-3,4-dimethyl-5-phenyl-1,3-oxazolidin-2-one | Organic compounds | Organoheterocyclic compounds | Azolidines | Oxazolidines | Details |
| heptadec-8-ene | Organic compounds | Hydrocarbons | Unsaturated hydrocarbons | Unsaturated aliphatic hydrocarbons | Details |
| (1s,2r,3r,4r,5r,6s,7s,8r,9r,10r,13r,14r,16s,17s,18r)-11-ethyl-5,7,8,14-tetrahydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 4-methoxybenzoate | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Diterpenoids | Details |
| methyl (3ar,3bs,5as,7s,9as,9br,11ar)-7-(acetyloxy)-1-hydroxy-9a-(hydroxymethyl)-2,3b,6,6,11,11a-hexamethyl-3-oxo-4h,5h,5ah,7h,8h,9h,9bh-cyclopenta[a]phenanthrene-3a-carboxylate | Organic compounds | Lipids and lipid-like molecules | Steroids and steroid derivatives | Steroid esters | Details |
| 3-({4,5-dihydroxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-5-hydroxy-2-(4-methoxyphenyl)-8-(3-methylbut-2-en-1-yl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one | Organic compounds | Organic acids and derivatives | Carboxylic acids and derivatives | Hexacarboxylic acids and derivatives | Details |
| 5,5,9-trimethyl-15-methylidene-16-oxo-11-oxapentacyclo[12.2.1.0¹,¹⁰.0⁴,⁹.0¹⁰,¹²]heptadecan-8-yl acetate | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Diterpenoids | Details |
| (1s,2r,4s,7s,8s,11r,12r,17s,19r)-7-(furan-3-yl)-1,8,12,16,16-pentamethyl-5,15-dioxo-3,6-dioxapentacyclo[9.8.0.0²,⁴.0²,⁸.0¹²,¹⁷]nonadec-13-en-19-yl acetate | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Triterpenoids | Details |
| (1r,15s)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]nonadeca-2(10),4,6,8-tetraene | Organic compounds | Alkaloids and derivatives | Ibogan-type alkaloids | Not Available | Details |
| (2s,3e,12bs)-2-{5-[(2s,3e,12br)-3-ethylidene-1h,2h,4h,6h,7h,12h,12bh-indolo[2,3-a]quinolizin-2-yl]furan-3-yl}-3-ethylidene-1h,2h,4h,6h,7h,12h,12bh-indolo[2,3-a]quinolizine | Organic compounds | Organoheterocyclic compounds | Indoles and derivatives | Pyridoindoles | Details |
| 3-[3-hydroxy-4-methoxy-2,5-bis(3-methylbut-2-en-1-yl)phenyl]-1-(2,4,6-trihydroxyphenyl)prop-2-en-1-one | Organic compounds | Phenylpropanoids and polyketides | Linear 1,3-diarylpropanoids | Chalcones and dihydrochalcones | Details |
| 1-{9,20-dihydroxy-8-methoxy-16-methyl-15-oxa-1,11-diazahexacyclo[15.3.1.0⁴,¹².0⁴,²⁰.0⁵,¹⁰.0¹³,¹⁸]henicosa-5,7,9-trien-11-yl}ethanone | Organic compounds | Alkaloids and derivatives | Strychnos alkaloids | Not Available | Details |
| (1s,4r,6r,7s,10r,11s,13s,15r)-6,7,11-tris(acetyloxy)-8-hydroxy-5,5,9-trimethyl-14-methylidene-3-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-15-yl acetate | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Diterpenoids | Details |
| (1r,3as,4s,5r,7as)-1,5-dimethyl-4-(2-methylprop-1-en-1-yl)-octahydroinden-4-ol | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Monoterpenoids | Details |
| 5-(5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl)-3-methylpentane-1,2,3-triol | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Diterpenoids | Details |
| methyl 2-{2-[6-(acetyloxy)-1-(furan-3-yl)-7-hydroxy-7a-methyl-4-methylidene-2,5,6,7-tetrahydro-1h-inden-5-yl]-2,6,6-trimethyl-5-oxocyclohex-3-en-1-yl}acetate | Organic compounds | Organic oxygen compounds | Organooxygen compounds | Carbonyl compounds | Details |
| 1-(3,4-dihydro-2h-pyridin-1-yl)deca-2,4,6-trien-1-one | Organic compounds | Organoheterocyclic compounds | Pyridines and derivatives | Hydropyridines | Details |
| epirubicin | Organic compounds | Phenylpropanoids and polyketides | Anthracyclines | Not Available | Details |
| (2r,3r,4s,5s,6r)-2-{[(1r,4s,4ar,8ar)-4-hydroxy-6-[(2r)-1-hydroxypropan-2-yl]-4,8a-dimethyl-1,2,3,4a,5,8-hexahydronaphthalen-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Terpene glycosides | Details |
| (1s,4r)-3,5,5-trimethyl-4-[(1e,3e,5e,7e,9e,11e,13e,15e,17e)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohex-1-en-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]cyclohex-2-en-1-ol | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Tetraterpenoids | Details |
| (3e)-5-[(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]-3-formylpent-3-enoic acid | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Diterpenoids | Details |
| (2s)-2-hydroxy-2-methyl-n-[(2s)-1-[(2e)-3-phenylprop-2-enoyl]pyrrolidin-2-yl]butanimidic acid | Organic compounds | Phenylpropanoids and polyketides | Cinnamic acids and derivatives | Not Available | Details |
| 6-(hydroxymethyl)-1,6-dimethyl-7h,8h,9h-phenanthro[1,2-b]furan-10,11-dione | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Diterpenoids | Details |
| (3z,5e,11e,13e)-16-[4-(2,4-dihydroxy-6-isopropyl-5-methyloxan-2-yl)-3-hydroxypentan-2-yl]-8-hydroxy-3,15-dimethoxy-5,7,9,11-tetramethyl-1-oxacyclohexadeca-3,5,11,13-tetraen-2-one | Organic compounds | Phenylpropanoids and polyketides | Macrolides and analogues | Not Available | Details |
| 2-{[3a,6,6,9a,11a-pentamethyl-1-(6-methyl-5-methylideneheptan-2-yl)-1h,2h,3h,4h,5h,5ah,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol | Organic compounds | Lipids and lipid-like molecules | Prenol lipids | Triterpenoids | Details |
