"Twins" retrives similar metabolites in chemical structure.
last update : 2020.01.06
KNApSAcK CID : ex.) C00000001


and

Similarity (%) : ex.) 98
% or more





INPUT WORD = C00007485 , 50% or more
[ Metabolite Name : Tetrachlorohydroquinone , 2,3,5,6-Tetrachlorohydroquinone ]
Number of matched data : 86

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00007496 Pentachlorophenol 95.83
C00007486 2,3,6-Trichloro-p-hydroquinone 91.67
C00016089 Tetrachloro-pyrocatechol 91.67
C00040791 2,4-Dichloro-5-methoxy-3-methylphenol 87.50
C00000231 cis-Jasmone
(Z)-Cinerone
Cinerone
83.33
C00001324 Tiglyl tiglate 83.33
C00007487 2,6-Dichloro-p-benzohydroquinone 83.33
C00010320 Fusalanipyrone
Fuselanopyrone
83.33
C00036516 3,5-Dichloro-4-methoxybenzaldehyde 83.33
C00041329 Alcalinaphenol A 83.33
C00041332 Alcalinaphenol D 83.33
C00046823 Methyl-beta-orcinol carboxylate 83.33
C00042102 3,4,6-Trichloro-2,5-dimethoxyphenol 82.14
C00042106 3,5,6-Trichloro-2,4-dimethoxyphenol 82.14
C00022621 (E,Z)-Marticaria ester 80.00
C00001313 (Z)-Jasmone
cis-Jasmone
3-Methyl-2-(2-pentenyl)-2-cyclopenten-1-one
Jasmone
79.17
C00002704 Paeonol 79.17
C00007309 Homogentisate
Homogentisic acid
79.17
C00010283 Cleviolide 79.17
C00010317 Dehydroelshotzione 79.17
C00010340 3-Methyl-5-(2-methylpropyl)-2-furancarboxaldehyde 79.17
C00010342 4-(4-Methyl-1,3-pentadienyl)-2(5H)-furanone
Scobinolide
79.17
C00010351 5-(1,1-Dimethyl-2-propenyl)-3-methyl-2(4H)-furanone 79.17
C00010536 Dehydroiridodiol 79.17
C00010862 2,5-Dihydroxy-p-cymene
Hydrothymoquinone
Thymohydroquinone
79.17
C00010876 Thymoquinone
p-Mentha-3,6-diene-2,5-dione
79.17
C00029353 CID is old! 79.17
C00029760 4-Methyl-2,6-dihydroxy-benzaldehyde
Atranol
79.17
C00036517 3,5-dichloro-4-methoxybenzyl alcohol 79.17
C00044431 2-Hydroxy-5-methoxybenzaldehyde 79.17
C00041330 Alcalinaphenol B 78.57
C00010361 4-Hydroxy-6-isopropyl-3,5-dimethyl-2H-pyran-2-one 76.92
C00037524 Multiflotriol 76.92
C00047902 Ginkgotoxin 76.92
C00000841 6-Oxocamphor 76.00
C00001287 Lachnophyllum ester 76.00
C00003044 Evodone 76.00
C00010398 8-Chloro-6-chloromethyl-2-methyl-2,6-octadien-1-ol 76.00
C00010727 Viburtinal 76.00
C00011050 (+-)-Asarinol A 76.00
C00019143 3-Hydroxycoumarin
3-Coumarinol
76.00
C00030482 Hexyl tiglate 76.00
C00031153 Rhodiolol A 76.00
C00000258 2,6-Dimethoxy-1,4-benzoquinone
2,6-Dimethoxy-p-benzoquinone
75.00
C00000486 6-Methylsalicylic acid
6MSA
75.00
C00000487 Orsellinic acid
2,4-Dihydroxy-6-methylbenzoic acid
4,6-Dihydroxy-2-methylbenzoic acid
Orsellic acid
75.00
C00002683 Vanillin 75.00
C00002693 3',4'-Dihydroxyacetophenone 75.00
C00003049 (+)-Menthofuran
(R)-(+)-Menthofuran
75.00
C00007310 Caffeyl alcohol 75.00
C00007511 Caffeoyl aldehyde
Caffeic aldehyde
3,4-Dihydroxycinnamaldehyde
Caffeylaldehyde
75.00
C00010313 Egomaketone
3-Penten-1-one
75.00
C00010314 (+)-Eldanolide
2(3H)-Furanone
75.00
C00010316 Elsholtzione 75.00
C00010328 Isoegomaketone 75.00
C00010336 Rosefuran
3-Methyl-2-(3-methyl-2-butenyl)furan
75.00
C00010343 2-(4-Methyl-3-pentenyl)-2-butene-1,4-diol
alpha-(Z)-Acaridiol
75.00
C00010344 Perillene
3-(4-Methyl-3-pentenyl)furan
75.00
C00010345 6-Methyl-2-vinyl-5-heptene-1,2-diol 75.00
C00010359 5-Ethylidene-5,6-dihydro-3,6,6-trimethyl-2-pyranone 75.00
C00010364 Marmelolactone A 75.00
C00010535 Epichrysomelidial
Dehydroiridodial
75.00
C00010824 (R)-Linden ether
3,9-Epoxy-p-mentha-1,4(8)-diene
75.00
C00010846 2-Hydroxy-p-mentha-1,4(8)-dien-3-one 75.00
C00010849 (4S-trans)-4-Hydroxy-2-methyl-5-(1-methylethyl)-2-cyclohexen-1-one 75.00
C00010850 (4S-cis)-4-Hydroxy-2-methyl-5-(1-methylethyl)-2-cyclohexen-1-one 75.00
C00010933 p-Menth-1-en-9-ol 75.00
C00016850 Xanthofusin 75.00
C00017066 4-Methoxy-2,5-toluquinone
5-Methoxy-p-toluquinone
Coprinin
NSC 3071
75.00
C00017929 3,4-Dihydroxytropolone
BMY 28438
75.00
C00023719 p-Toluquinone 75.00
C00023720 Toluquinol 75.00
C00023984 gamma-Decalactone 75.00
C00023985 delta-Decalactone
5-Decanolide
75.00
C00031089 Methyl protocatechuate
Protocatechuic acid methyl ester
75.00
C00031535 2,3-Dimethoxy-1,4-benzoquinone 75.00
C00031551 3-(3,4-Dihydroxyphenyl)-1-propanol 75.00
C00032617 2,5-Dihydroxy-4-methylacetophenone 75.00
C00032638 3,5-Dimethyl-4-hydroxy benzaldehyde
4-Hydroxy-3,5-dimethylbenzaldehyde
75.00
C00035903 cis-Isoeugenol
Z-Isoeugenol
75.00
C00036783 Atraric acid
Methyl beta-Orsellinate
75.00
C00038251 3-Bromo-4,5-dihydroxybenzaldehyde 75.00
C00041333 Alcalinaphenol E 75.00
C00043206 5-(4-Pentenyl)-2-furaldehyde 75.00
C00043215 5-Pentyl-2-furaldehyde 75.00
C00045543 2-Hydroxy-3,5,5-trimethylcyclohex-2-ene-1,4-dione 75.00
Page Top