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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.

540 compounds · page 7 of 11 · clear filters

S. No. COCONUT ID Compound Name Molecular Formula Molecular Weight Log P NP Pathway / Class Reported in Action
301 CNP0337642.1 .alpha.-Bisabolol acetate C17H28O2 264.41 4.80 Terpenoids
Bisabolane sesquiterpenoids		 Vitex negundo View
302 CNP0262195.5 .alpha.-Cadinol C15H26O 222.37 3.78 Terpenoids
Cadinane sesquiterpenoids		 Centella asiatica Acorus calamus Daucus carota Mentha Arvensis Vitex negundo View
303 CNP0243697.2 (+) Menthol C10H20O 156.27 2.44 Terpenoids
Menthane monoterpenoids		 Mentha Arvensis Vitex negundo Cassia angustifolia View
304 CNP0111925.1 (1R,2S,3S,7S,8R,9S,12R,13R,14S,15R,16R,17S)-3,8,12,13,15,16-hexahydroxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadec-5-ene-4,11-dione C20H28O9 412.44 -2.12 Terpenoids
Quassinoids		 Vitex negundo View
305 CNP0174666.17 (1R,2S,4aR,8aR)-1-(3-hydroxy-3-methylpent-4-enyl)-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol C20H36O2 308.51 4.70 Terpenoids
Labdane diterpenoids		 Vitex negundo View
306 CNP0193444.1 (1S,4aS,6S,7R,7aS)-1-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxyoxan-2-yl]oxy-6-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid C25H30O12 522.50 -0.27 Terpenoids
Iridoids monoterpenoids		 Vitex negundo View
307 CNP0167903.5 (1S,4aS,7S,7aS)-1-[(3R,4S,5S,6R)-4,5-dihydroxy-3-(4-hydroxybenzoyl)oxy-6-(hydroxymethyl)oxan-2-yl]oxy-7-hydroxy-7-methyl-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylic acid C23H28O12 496.47 -0.52 Terpenoids
Iridoids monoterpenoids		 Vitex negundo View
308 CNP0560283.1 (2R,3R,4S,5R)-2-(6-hydroxy-2-imino-3H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol C10H13N5O5 283.24 -2.44 Carbohydrates
Purine nucleos(t)ides		 Vitex negundo View
309 CNP0289734.2 (E,6R)-6-[(2R,5S)-5-[(2R,5R)-5-[(2S,5R)-5-[(E,2R)-6-hydroperoxy-2-hydroxy-6-methylhept-4-en-2-yl]-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]-2-methylhept-3-ene-2,6-diol C30H52O8 540.74 4.84 Terpenoids
Acyclic triterpenoids		 Vitex negundo View
310 CNP0289734.1 (E,6S)-6-[(2R,5S)-5-[(2R,5R)-5-[(2S,5R)-5-[(E,2S)-6-hydroperoxy-2-hydroxy-6-methylhept-4-en-2-yl]-2-methyloxolan-2-yl]oxolan-2-yl]-5-methyloxolan-2-yl]-2-methylhept-3-ene-2,6-diol C30H52O8 540.74 4.84 Terpenoids
Acyclic triterpenoids		 Vitex negundo View
311 CNP0156738.2 [(1S,3R,4aR,5S,7aS)-5-hydroxy-3-methoxy-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1H,3H,4H,4aH,5H,7aH-cyclopenta[c]pyran-7-yl]methyl 4-hydroxybenzoate C23H30O12 498.48 -1.38 Terpenoids
Iridoids monoterpenoids		 Vitex negundo View
312 CNP0141197.3 [(1S,4aR,5S,7aS)-5-hydroxy-1-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-7-yl]methyl 4-hydroxybenzoate C22H26O11 466.44 -1.23 Terpenoids
Iridoids monoterpenoids		 Vitex negundo View
313 CNP0208693.3 [(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[7-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-6,8-dimethoxy-4-oxochromen-5-yl]oxyoxan-2-yl]methyl acetate C26H28O14 564.50 0.65 Shikimates and Phenylpropanoids
Flavones		 Vitex negundo View
314 CNP0562245.1 [5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenyl] (2S,3S,4S,5R,6R)-3,4,5-trihydroxy-6-methoxyoxane-2-carboxylate C22H20O12 476.39 -0.06 Shikimates and Phenylpropanoids
Flavones		 Vitex negundo View
315 CNP0107435.0 1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16),10,12,14-hexaen-2-one C14H10N2O 222.25 2.78 Alkaloids
Carboline alkaloids		 Vitex negundo View
316 CNP0215243.0 12-hydroxy-13-methoxy-1,6-diazatetracyclo[7.6.1.0^{5,16}.0^{10,15}]hexadeca-3,5,7,9(16),10,12,14-heptaen-2-one C15H10N2O3 266.26 2.15 Alkaloids
Carboline alkaloids		 Vitex negundo View
317 CNP0482777.0 13-hydroxy-2-oxo-1,6-diazatetracyclo[7.6.1.0?,¹?.0¹?,¹?]hexadeca-5(16),6,8,10,12,14-hexaen-6-ium-6-olate C14H10N2O3 254.24 1.72 Alkaloids
Carboline alkaloids		 Vitex negundo View
318 CNP0597458.0 13-hydroxy-2-oxo-1,6-diazatetracyclo[7.6.1.0⁵,¹⁶.0¹⁰,¹⁵]hexadeca-3,5,7,9(16),10(15),11,13-heptaen-6-ium-6-olate C14H8N2O3 252.23 1.38 Alkaloids
Carboline alkaloids		 Vitex negundo View
319 CNP0478987.0 13-methoxy-2-oxo-1,6-diazatetracyclo[7.6.1.0?,¹?.0¹?,¹?]hexadeca-5(16),6,8,10,12,14-hexaen-6-ium-6-olate C15H12N2O3 268.27 2.02 Alkaloids
Carboline alkaloids		 Vitex negundo View
320 CNP0210398.5 1H-Cycloprop[e]azulen-4-ol, decahydro-1,1,4,7-tetramethyl-, [1ar-(1a.alpha.,4.beta.,4a.beta.,7.alpha.,7a.beta.,7b.alpha.)]- C15H26O 222.37 3.47 Terpenoids
Aromadendrane sesquiterpenoids		 Artemisia annua Foeniculum vulgare Vitex negundo Valeriana jatamansi View
321 CNP0542399.0 2-(3-hydroxy-4,5-dimethoxyphenyl)-3,6,7-trimethoxychromen-4-one C20H20O8 388.37 3.21 Shikimates and Phenylpropanoids
Flavonols		 Vitex negundo View
322 CNP0184069.5 25269-17-4 C20H34O 290.49 5.81 Terpenoids
Cembrane diterpenoids		 Vitex negundo View
323 CNP0193057.2 4-[[(3R,4S,5S)-5-(4-hydroxy-3-methoxyphenyl)-4-(hydroxymethyl)oxolan-3-yl]methyl]-2-methoxyphenol C20H24O6 360.41 2.65 Shikimates and Phenylpropanoids
Furanoid lignans		 Vitex negundo View
324 CNP0582668.0 4-[5-(3,4,6,6a-tetrahydro-1H-furo[3,4-c]furan-3a-yl)-1,3-benzodioxol-4-yl]-2-methoxyphenol C20H20O6 356.37 2.71 Shikimates and Phenylpropanoids
Furofuranoid lignans		 Vitex negundo View
325 CNP0223705.1 6-Epi-beta-bisabolol C15H26O 222.37 4.23 Terpenoids
Bisabolane sesquiterpenoids		 Matricaria chamomilla Vitex negundo Gossypium hirsutum View
326 CNP0173043.2 82358-44-9 C17H18O3 270.33 3.73 Shikimates and Phenylpropanoids
Cinnamoyl phenols		 Vitex negundo View
327 CNP0328972.0 845786-99-4 C56H104O4 841.44 19.06 Fatty acids Vitex negundo View
328 CNP0597737.0 9-(4-hydroxy-3-methoxy-phenyl)-6-methoxy-1~{H}-benzo[f]isoindole-3,7-diol C20H17NO5 351.36 3.75 Shikimates and Phenylpropanoids Vitex negundo View
329 CNP0331783.0 9-(4-hydroxy-3-methoxy-phenyl)-6-methoxy-3~{H}-benzo[f]isoindole-1,7-diol C20H17NO5 351.36 3.75 Shikimates and Phenylpropanoids Vitex negundo View
330 CNP0141197.2 Agnuside C22H26O11 466.44 -1.23 Terpenoids
Iridoids monoterpenoids		 Vitex negundo View
331 CNP0141197.4 Agnuside C22H26O11 466.44 -1.23 Terpenoids
Iridoids monoterpenoids		 Vitex negundo View
332 CNP0354243.4 Apigenin 6-C-alpha-L-arabinopyranoside-8-C-beta-D-glucopyranoside C26H28O14 564.50 -1.75 Shikimates and Phenylpropanoids
Flavones		 Artemisia annua Vitex negundo Glycyrrhiza glabra View
333 CNP0276810.2 Aptosimone C20H16O7 368.34 2.75 Shikimates and Phenylpropanoids
Furofuranoid lignans		 Vitex negundo View
334 CNP0274815.8 Caryophyllene oxide 2 C15H24O 220.36 3.94 Terpenoids
Caryophyllane sesquiterpenoids		 Acorus calamus Artemisia annua Daucus carota Mentha Arvensis Vitex negundo Valeriana jatamansi Cassia angustifolia View
335 CNP0180359.4 cis-.alpha.-Bergamotene C15H24 204.36 4.73 Terpenoids
Bergamotane sesquiterpenoids		 Vitex negundo View
336 CNP0382935.3 CLOVENE C15H24 204.36 4.56 Terpenoids
Clovane sesquiterpenoids		 Vitex negundo View
337 CNP0357544.1 delta-Amorphene C15H24 204.36 4.73 Terpenoids
Cadinane sesquiterpenoids		 Acorus calamus Artemisia annua Foeniculum vulgare Daucus carota Vitex negundo Valeriana jatamansi Cassia angustifolia View
338 CNP0396954.1 Eurycolactone F C21H28O8 408.45 -0.02 Terpenoids
Quassinoids		 Vitex negundo View
339 CNP0175466.1 Eurycomanol 2-O- C26H36O14 572.56 -4.21 Terpenoids
Quassinoids		 Vitex negundo View
340 CNP0222008.1 Eurycomaoside C25H38O12 530.57 -2.98 Terpenoids
Quassinoids		 Vitex negundo View
341 CNP0210398.6 Globulol C15H26O 222.37 3.47 Terpenoids
Aromadendrane sesquiterpenoids		 Artemisia annua Foeniculum vulgare Vitex negundo Cinnamomum verum View
342 CNP0190202.1 Guaia-1(10),11-diene C15H24 204.36 4.73 Terpenoids
Guaiane sesquiterpenoids		 Acorus calamus Vitex negundo Valeriana jatamansi View
343 CNP0182184.2 methyl 2-[(3R,4R)-4-[(1R,3aS,8aR)-1,4,4-trimethyl-8-methylidene-3,3a,5,6,7,8a-hexahydro-2H-azulen-1-yl]-5-oxooxolan-3-yl]acetate C21H32O4 348.48 4.14 Terpenoids Vitex negundo View
344 CNP0193542.0 n-pentyl beta-carboline-1-propionate C19H22N2O2 310.40 4.38 Alkaloids
Carboline alkaloids		 Vitex negundo View
345 CNP0244443.1 NEGUNDOIN B C21H32O5 364.48 4.31 Terpenoids
Norlabdane diterpenoids		 Vitex negundo View
346 CNP0187150.3 PASAKBUMIN B C20H24O10 424.40 -2.62 Terpenoids
Quassinoids		 Vitex negundo View
347 CNP0174878.1 PMMLIVYPEUJENN-ZIAGYGMSSA-N C15H24 204.36 4.73 Terpenoids
Caryophyllane sesquiterpenoids		 Acorus calamus Artemisia annua Foeniculum vulgare Daucus carota Vitex negundo Valeriana jatamansi Cassia angustifolia Emblica officinalis View
348 CNP0109275.3 VERBENONE C10H14O 150.22 2.18 Terpenoids
Pinane monoterpenoids		 Boswellia serrata Rosmarinus officinalis Vitex negundo Gossypium hirsutum View
349 CNP0490949.0 VITEDOAMINE B C20H17NO5 351.36 3.18 Alkaloids Vitex negundo View
350 CNP0177349.2 Vitexin 2''-O-glucoside C27H30O15 594.52 -2.08 Shikimates and Phenylpropanoids
Flavones		 Vitex negundo 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.