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COCONUT Compounds

Natural products reported here are from the COCONUT (COlleCtion of Open Natural prodUcTs) database. Compounds also curated and marked in GR-MAPs/Molecules database In GR-MAPs.

10,380 compounds · page 12 of 208

S. No. COCONUT ID Compound Name Molecular Formula Molecular Weight Log P NP Pathway / Class Reported in Action
551 CNP0137327.0 3-Methyl-3-buten-2-one C5H8O 84.12 1.15 Fatty acids
Acyclic monoterpenoids		 Cassia angustifolia View
552 CNP0267777.0 3-methyl-9H-carbazol-2-ol C13H11NO 197.24 3.34 Alkaloids
Carbazole alkaloids		 Murraya koenigii View
553 CNP0154350.0 3-Methyl-9H-carbazole C13H11N 181.24 3.63 Alkaloids
Carbazole alkaloids		 Murraya koenigii View
554 CNP0200023.0 3-Methylbutanal C5H10O 86.13 1.23 Fatty acids
Fatty aldehydes		 Nicotiana tabacum Foeniculum vulgare Daucus carota Cassia angustifolia Crocus sativus Gossypium hirsutum Solanum lycopersicum View
555 CNP0206932.0 3-METHYLPYRIDINE C6H7N 93.13 1.39 Alkaloids
Pyridine alkaloids		 Nicotiana tabacum View
556 CNP0289313.2 3-O-Acetyloleanolic acid C32H50O4 498.75 7.80 Terpenoids
Oleanane triterpenoids		 Rosmarinus officinalis Viola odorata Vitex negundo View
557 CNP0220155.2 3-O-deacetylorthosiphol U C31H40O10 572.65 2.38 Terpenoids
Pimarane and Isopimarane diterpenoids		 Oryza sativa View
558 CNP0368158.1 3-O-Feruloylquinic acid C17H20O9 368.34 -0.34 Shikimates and Phenylpropanoids
Cinnamic acids and derivatives		 Foeniculum vulgare Daucus carota View
559 CNP0234522.0 3-O-methylellagic acid C15H8O8 316.22 1.62 Shikimates and Phenylpropanoids
Gallotannins		 Lagerstroemia speciosa Eucalyptus citriodora View
560 CNP0115195.0 3-O-Methylquercetin C16H12O7 316.27 2.29 Shikimates and Phenylpropanoids
Flavonols		 Nicotiana tabacum Artemisia annua View
561 CNP0381627.0 3-Octanone C8H16O 128.21 2.55 Fatty acids
Oxygenated hydrocarbons		 Arabidopsis thaliana Daucus carota Rosmarinus officinalis Mentha Arvensis Emblica officinalis Canabis Sativa View
562 CNP0280590.1 3-Oxoanticopalic Acid C20H30O3 318.46 4.78 Terpenoids
Labdane diterpenoids		 Callicarpa macrophylla View
563 CNP0353125.0 3-Phenylpropanal C9H10O 134.18 1.82 Shikimates and Phenylpropanoids
Cinnamic acids and derivatives		 Cinnamomum verum View
564 CNP0266306.0 3-Phenylpropyl acetate C11H14O2 178.23 2.18 Shikimates and Phenylpropanoids Cinnamomum verum View
565 CNP0398040.0 3-PHENYLPYRIDINE C11H9N 155.20 2.75 Alkaloids
Pyridine alkaloids		 Mentha piperita View
566 CNP0275958.0 3-Pyridinecarboxaldehyde C6H5NO 107.11 0.89 Alkaloids
Pyridine alkaloids		 Nicotiana tabacum View
567 CNP0242282.1 3,4-Dicaffeoylquinic acid C25H24O12 516.46 1.03 Shikimates and Phenylpropanoids
Cinnamic acids and derivatives		 Andrographis paniculata Centella asiatica Nicotiana tabacum Artemisia annua Daucus carota Vitex negundo View
568 CNP0203672.0 3,4-Dihydroxybenzaldehyde C7H6O3 138.12 0.91 Shikimates and Phenylpropanoids
Shikimic acids and derivatives		 Mentha piperita Vitex negundo Chlorophytum brovillianum Commiphora wightii View
569 CNP0348948.0 3,4-DIHYDROXYBENZOIC ACID C7H6O4 154.12 0.80 Shikimates and Phenylpropanoids
Simple phenolic acids		 Andrographis paniculata Ocimum sanctum Centella asiatica Arabidopsis thaliana Foeniculum vulgare Mentha piperita Daucus carota Salvia officinalis Origanum vulgare Ocimum tenuiflorum Vitex negundo Valeriana jatamansi Cassia angustifolia Cinnamomum verum Commiphora wightii Crocus sativus Emblica officinalis Oryza sativa Gossypium hirsutum View
570 CNP0276169.0 3,4-Dihydroxyphenylacetic acid C8H8O4 168.15 0.72 Shikimates and Phenylpropanoids
Simple phenolic acids		 Salvia officinalis View
571 CNP0216130.0 3,4-Dimethoxybenzaldehyde C9H10O3 166.18 1.52 Shikimates and Phenylpropanoids
Cinnamic acids and derivatives		 Mentha piperita View
572 CNP0328859.0 3,4-Dimethoxybenzoic acid C9H10O4 182.17 1.40 Shikimates and Phenylpropanoids
Cinnamic acids and derivatives		 Foeniculum vulgare View
573 CNP0523320.0 3,4-Dimethyl-2-phenylthiomorpholine # C12H17NS 207.34 2.79 Alkaloids
Piperidine alkaloids		 Gymnema sylvester View
574 CNP0084292.0 3,4-Dimethylthiophene C6H8S 112.20 2.36 Azadirachta indica View
575 CNP0276074.1 3,4,5-tri-O-Galloylshikimic acid C28H22O17 630.47 1.43 Shikimates and Phenylpropanoids
Gallotannins		 Terminalia chebula View
576 CNP0294155.0 3,4,5-TRIMETHOXYBENZALDEHYDE C10H12O4 196.20 1.52 Shikimates and Phenylpropanoids
Minor lignans		 Acorus calamus Piper solmsianum View
577 CNP0274277.1 3,4,6-tri-O-galloyl-beta-d-glucose C27H24O18 636.47 -0.28 Shikimates and Phenylpropanoids
Gallotannins		 Terminalia chebula View
578 CNP0303701.0 3,5-Di-tert-butyl-4-hydroxybenzaldehyde C15H22O2 234.34 3.80 Shikimates and Phenylpropanoids Nicotiana tabacum View
579 CNP0104195.0 3,5-Dimethyl-1-hexene C8H16 112.22 2.85 Fatty acids
Acyclic monoterpenoids		 Mentha Arvensis View
580 CNP0302458.1 3,5,7-trihydroxy-2-(4-hydroxyphenyl)-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one C21H20O11 448.38 -0.20 Shikimates and Phenylpropanoids
Flavonols		 Viola odorata View
581 CNP0135794.0 3'-Methoxydaidzein C16H12O5 284.27 2.88 Shikimates and Phenylpropanoids
Isoflavones		 Tephrosia purpurea View
582 CNP0258199.0 3',4',5,6-Tetrahydroxy-3,7-dimethoxyflavone C17H14O8 346.29 2.30 Shikimates and Phenylpropanoids
Flavonols		 Artemisia annua View
583 CNP0156930.1 31-Demethylbuxaminol C27H46N2O 414.68 4.97 Alkaloids
Steroidal alkaloids		 Tanacetum cinerariifolium View
584 CNP0086138.1 31297-79-7 C36H58O10 650.85 2.44 Terpenoids
Oleanane triterpenoids		 Terminalia arjuna Terminalia chebula View
585 CNP0235798.2 32142-31-7 C14H18O9 330.29 -1.43 Shikimates and Phenylpropanoids
Simple phenolic acids		 Ocimum sanctum Ocimum tenuiflorum View
586 CNP0567682.1 33069-62-4 C47H51NO14 853.92 3.74 Terpenoids
Taxane diterpenoids		 Chlorophytum brovillianum View
587 CNP0163430.2 3396-99-4 C7H14O6 194.18 -2.57 Carbohydrates
Disaccharides		 Chlorophytum brovillianum View
588 CNP0358032.0 3464-66-2 C13H10N2O2 226.24 2.50 Alkaloids
Carboline alkaloids		 Vitex negundo View
589 CNP0317969.3 34984-78-6 C21H30O3 330.47 4.71 Polyketides
Cannabinoids		 Canabis Sativa View
590 CNP0175157.2 35727-45-8 C15H26O 222.37 3.80 Terpenoids
Elemane sesquiterpenoids		 Artemisia annua View
591 CNP0222236.1 357645-16-0 C20H20O6 356.37 2.45 Shikimates and Phenylpropanoids
Arylnaphthalene and aryltetralin lignans		 Vitex negundo View
592 CNP0080238.0 37347-91-4 C22H30O4 358.48 5.09 Terpenoids
Cannabinoids		 Canabis Sativa View
593 CNP0126567.1 37971-69-0 C16H14O6 302.28 1.78 Shikimates and Phenylpropanoids
Dihydroflavonols		 Eucalyptus citriodora View
594 CNP0207147.2 3beta-hydroxy-(22e,24r)-ergosta-5,8,22-trien-7-one C28H42O2 410.64 6.65 Terpenoids
Ergostane steroids		 Matricaria chamomilla View
595 CNP0227678.6 3beta-hydroxydihydrocostunolide C15H22O3 250.34 2.60 Terpenoids
Germacrane sesquiterpenoids		 Artemisia annua View
596 CNP0256299.1 3beta-Methoxy-2,3-dihydrowithaferin A C29H42O7 502.65 3.20 Terpenoids
Ergostane steroids		 Withania somnifera View
597 CNP0289995.4 3EEC4Q65S4 C19H30O7 370.44 0.31 Terpenoids
Megastigmanes		 Salvia officinalis View
598 CNP0167552.1 4-(beta-D-glucosyloxy)benzoic acid C13H16O8 300.26 -1.44 Shikimates and Phenylpropanoids
Simple phenolic acids		 Ocimum sanctum Foeniculum vulgare Ocimum tenuiflorum View
599 CNP0111869.0 4-acetylbenzo[d]oxazol-2(3H)-one C9H7NO3 177.16 1.32 Alkaloids Matricaria chamomilla View
600 CNP0370958.0 4-Allyl-2,6-dimethoxyphenol C11H14O3 194.23 2.14 Shikimates and Phenylpropanoids
Cinnamic acids and derivatives		 Piper auritum View

Data from COCONUT (COlleCtion of Open Natural prodUcTs), released under CC0. Chandrasekhar V. et al. COCONUT 2.0: a comprehensive overhaul and curation of the collection of open natural products database. Nucleic Acids Research (2024), doi:10.1093/nar/gkae1063.