"Twins" retrives similar metabolites in chemical structure. |
last update : 2020.01.06 |
INPUT WORD = C00011011 , 50% or more | |
[ Metabolite Name : 2-Hydroxy-3-isopropyl-2,4,6-cycloheptatrien-1-one , alpha-Thujaplicin ] | |
Number of matched data : 75 |
CID | Metabolite Name | Structural formula | Metabolite Activity | Similarity (%) |
---|---|---|---|---|
C00003062 | beta-Thujaplicin | 95.83 | C00003063 | gamma-Thujaplicin | 95.83 | C00011009 | beta-Dolabrin | 95.83 | C00011000 | 2,7-Dihydroxy-3-isopropyl-2,4,6-cycloheptatrienone | 92.31 | C00011001 | Pygmaein | 92.31 | C00030934 | p-Cymene-2,3-diol | 91.67 | C00010862 | 2,5-Dihydroxy-p-cymene Hydrothymoquinone |
87.50 | C00010876 | Thymoquinone p-Mentha-3,6-diene-2,5-dione |
87.50 | C00010908 | 3-Hydroxy-alpha,alpha,4-trimethylbenzyl alcohol | 87.50 | C00011012 | 4-Isopropyl-2,4,6-cycloheptatrien-1-one Nezukone |
87.50 | C00011002 | Isopygmaein | 85.71 | C00011010 | alpha-Dolabrinol | 84.62 | C00018324 | Siccayne | 84.62 | C00037524 | Multiflotriol | 84.62 | C00010813 | (+)-2,3-Dihydro-6-methyl-3-methylene-2-benzofuranol | 84.00 | C00000155 | m-Thymol Thymol |
83.33 | C00000156 | Carvacrol | 83.33 | C00002689 | Acetovanillone Apocynin |
83.33 | C00010340 | 3-Methyl-5-(2-methylpropyl)-2-furancarboxaldehyde | 83.33 | C00010843 | Macropone | 83.33 | C00010864 | Cymorcin | 83.33 | C00010866 | 3-Methoxy-p-cymene Thymyl methyl ether 1-Isopropyl-2-methoxy-4-methylbenzene 2-Isopropyl-5-methylanisole Thymol methyl ether Methyl thymyl ether |
83.33 | C00010906 | Dehydrocarvacrol 5-Isopropenyl-2-methylphenol |
83.33 | C00010968 | 2-Isopropyl-p-cresol 4-Methyl-2-isopropylphenol |
83.33 | C00032617 | 2,5-Dihydroxy-4-methylacetophenone | 83.33 | C00032636 | 3,4-Dimethoxy-styrene | 83.33 | C00032695 | Acetoisovanillone Isoacetovanillone |
83.33 | C00040158 | RKB 3564S | 83.33 | C00041329 | Alcalinaphenol A | 83.33 | C00042023 | 1,2,3-Trimethoxybenzene | 83.33 | C00042777 | N-Methyldopamine | 83.33 | C00048139 | Speciosin G | 83.33 | C00021948 | Dihydropalutropone | 81.48 | C00010857 | 2-(2Hydroxy-4-methylphenyl)-1,3-propanediol 9,10-Dihydroxythymol |
80.77 | C00010909 | 5-(1-Methoxy-1-methylethyl)-2-methyl-phenol NSC 379495 |
80.77 | C00002154 | Echinopsine | 80.00 | C00026243 | Glycorine 1-Methyl-4-quinazolone |
80.00 | C00000258 | 2,6-Dimethoxy-1,4-benzoquinone 2,6-Dimethoxy-p-benzoquinone |
79.17 | C00000487 | Orsellinic acid 2,4-Dihydroxy-6-methylbenzoic acid 4,6-Dihydroxy-2-methylbenzoic acid Orsellic acid |
79.17 | C00001408 | Dopamine | 79.17 | C00001424 | Noradrenaline L-Noradrenaline Norepinephrine (-)-Norepinephrine |
79.17 | C00002646 | Syringol | 79.17 | C00002669 | Pyrocatechuic acid o-Pyrocatechuic acid 2,3-Dihydroxybenzoic acid |
79.17 | C00002682 | Vanillic acid 3-Methoxy-4-hydroxybenzoic acid |
79.17 | C00002683 | Vanillin | 79.17 | C00002693 | 3',4'-Dihydroxyacetophenone | 79.17 | C00002704 | Paeonol | 79.17 | C00002713 | (E)-Anethole Anethole |
79.17 | C00002740 | Methyl chavicol Estragole Estragol Esdragol |
79.17 | C00003039 | Cumin aldehyde Cuminal 4-Isopropyl benzaldehyde Cuminaldehyde Cuminyl aldehyde Cumaldehyde |
79.17 | C00007309 | Homogentisate Homogentisic acid |
79.17 | C00010316 | Elsholtzione | 79.17 | C00010328 | Isoegomaketone | 79.17 | C00010341 | 3-(4-Methyl-1,4-pentadienyl)furan Lepalene |
79.17 | C00010359 | 5-Ethylidene-5,6-dihydro-3,6,6-trimethyl-2-pyranone | 79.17 | C00010851 | Pseudodiosphenol | 79.17 | C00010858 | 4-Isopropenylbenzaldehyde | 79.17 | C00010918 | (1R-trans)-1-Methyl-4-(1-methylethyl)-4-cyclohexene-1,2-diol | 79.17 | C00017929 | 3,4-Dihydroxytropolone BMY 28438 |
79.17 | C00029502 | 3-Hydroxy-4-methoxybenzoic acid Isovanillic acid |
79.17 | C00030933 | p-Cymen-8-ol | 79.17 | C00031535 | 2,3-Dimethoxy-1,4-benzoquinone | 79.17 | C00032269 | CID is old! | 79.17 | C00032864 | Cumin alcohol p-Cymen-7-ol Cuminyl alcohol p-Isopropylbenzyl alcohol |
79.17 | C00033837 | Ethylparaben | 79.17 | C00035454 | 1,3,5-Trimethoxybenzene | 79.17 | C00036387 | 1,4-p-Menthadien-7-ol | 79.17 | C00036581 | 4-Isopropylbenzoic acid cumic acid |
79.17 | C00037604 | p-Cymen-9-ol | 79.17 | C00040996 | 3,4-Dihydroxybenzeneacetic acid Homoprotocatechuic acid |
79.17 | C00041332 | Alcalinaphenol D | 79.17 | C00043206 | 5-(4-Pentenyl)-2-furaldehyde | 79.17 | C00043215 | 5-Pentyl-2-furaldehyde | 79.17 | C00044457 | 4-Allyl-pyrocatechol 4-Allylcatechol |
79.17 | C00047668 | CID is old! | 79.17 |