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


and

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




INPUT WORD = C00038116 , 50% or more
[ Metabolite Name : 10-Acetoxy-8,9-epoxythymolisobutyrate ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00021113 2-[4-Methyl-2-(2-methylpropoxy)phenyl]-oxiranemethanol acetate 95.35
C00042178 8,10-Epoxy-9-acetoxythymol angelate 93.33
C00021112 2-[4-Methyl-2-(2-methylpropoxy)phenyl]-2-[(2-methylpropoxy)methyl]-oxirane 90.70
C00010831 Diester with 4-(1,2-epoxy-1-methylethyl)-3-hydroxybenzyl alc. isobutyric acid 89.36
C00035708 Officinalin isobutyrate 88.37
C00037655 Piriferine
(+)-Piriferine		 86.05
C00038481 Aposphaerin C 86.05
C00045259 Chavicol beta-D-glucoside 86.05
C00049752 Tournefolin A
(-)-Tournefolin A		 86.05
C00010832 2-Methyl-4-(1,2-epoxy-1-methylethyl)-3-hydroxybenzyl ester isobutyrate 85.71
C00010837 2-Methyl-2-[2-[(acetyloxy)methyl]oxiranyl]-4-methoxy-5-methylphenyl ester 85.71
C00007979 2,2,4-Trimethyl-6-(1-oxo-3-phenylpropyl)-1,3,5-cyclohexanetrione 84.44
C00024140 Bungeiside B 84.44
C00036007 3,5-Dihydroxyphenethyl alcohol 3-O-beta-glucopyranoside 84.44
C00010833 2-Methyl-4-methoxy-5-methyl-2-[2-[(2-methyl-1-oxopropoxy)methyl]oxiranyl]phenyl ester 84.31
C00020730 Penziafulvenolide 84.09
C00020786 Zuurbergenin 84.09
C00049307 Sporovexin C
(-)-Sporovexin C		 84.09
C00012387 [3aR-(3aR*,5Z,9E,11aS*)]-6-[(Acetyloxy)methyl]-3a,4,7,8,11,11a-hexahydro-10-methyl-3-methylenecyclodeca[b]furan-2(3H)-one 83.72
C00020178 3-Acetoxy-8-calamenenone
(1S,4R)-7-Acetoxycalamenen-3-one		 83.72
C00021109 2-(Acetyloxy)-1-(7-methoxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-ethanone 83.72
C00028428 CID is old! 83.72
C00030420 Goniodiol-8-monoacetate 83.72
C00030728 Mansonone N
(+)-Mansonone N		 83.72
C00031186 Rosin
Rosin X
(-)-Rosin
trans-Cinnamyl beta-D-glucopyranoside		 83.72
C00037246 Heliannuol I
(-)-Heliannuol I		 83.72
C00044035 (+)-Toddanol 83.72
C00044349 Toddanone 83.72
C00046531 Xestodecalactone B
(+)-Xestodecalactone B		 83.72
C00045150 1',2'-Epoxy-3',4'-di-isobutyryl-Z-coniferyl alcohol 83.67
C00035951 4-O-Cinnamoyl quinic acid 82.98
C00012199 Herbolide B 82.61
C00020476 Achillicin 82.61
C00011755 Herbolide D 82.22
C00020336 Xanthanol
Xanthumanol
2-Acetylivalbin		 82.22
C00023457 Fregenedadiol 82.22
C00024139 Bungeiside A 82.22
C00030716 Manglieside A 82.22
C00030898 Osmanthuside F 82.22
C00031817 Glochidacuminoside A
(-)-Glochidacuminoside A		 82.22
C00032356 Thymol glucoside
Thymol-beta-D-glucoside		 82.22
C00033260 Odorine 82.22
C00033723 Cimidahurine 82.22
C00045594 8-Hydroxy-9-isobutyryloxy-10(2)-methylbutyrylthymol 82.00
C00012933 [3aR-(3aalpha,4aalpha,6beta,8abeta,9aalpha)]-6-(Acetyloxy)-3a,4,4a,5,6,8a,9,9a-octahydro-8a-methyl-3,5-bis(methylene)naphtho[2,3-b]furan-2(3H)-one 81.82
C00015155 MF-EA 705alpha 81.82
C00018571 BBM 2040A
Chicamycin A		 81.82
C00019881 cis-Grandmarin 81.82
C00029281 (-)-Hongconin 81.82
C00039451 Isopurpurasol
(+)-Isopurpurasol		 81.82
C00041278 5-(1,2-Diacetoxyethyl)-2-(E)-hept-5-ene-1,3-diynylthiophene 81.82
C00049503 CID is old! 81.82
C00049504 Oidiolactone F
(-)-Oidiolactone F		 81.82
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