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


and

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




INPUT WORD = C00010835 , 50% or more
[ Metabolite Name : (E)-2-Methyl-[2-[5-methoxy-4-methyl-2-(2-methyl-1-oxopropoxy)phenyl]oxiranyl]methyl ester ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010834 (E,E)-2-Methyl-4-methoxy-5-methyl-2-[2-[[(2-methyl-1-oxo-2-butenyl)oxy]methyl]oxiranyl]phenyl ester 94.55
C00010833 2-Methyl-4-methoxy-5-methyl-2-[2-[(2-methyl-1-oxopropoxy)methyl]oxiranyl]phenyl ester 94.34
C00010836 (E)-2-Methyl-4-methoxy-5-methyl-2-[2-[(2-methyl-1-oxopropoxy)methyl]oxiranyl]phenyl ester 92.45
C00010837 2-Methyl-2-[2-[(acetyloxy)methyl]oxiranyl]-4-methoxy-5-methylphenyl ester 90.57
C00011612 2,5-Di-O-methylsenecioodontol 88.89
C00010832 2-Methyl-4-(1,2-epoxy-1-methylethyl)-3-hydroxybenzyl ester isobutyrate 88.68
C00033552 2-Hydroxy-2-(2-hydroxy-4-methylphenyl)propane-1,3-diyl (2Z,2'Z)- bis(2-methylbut-2-enoate)
Hofmeisterin IV		 88.68
C00045594 8-Hydroxy-9-isobutyryloxy-10(2)-methylbutyrylthymol 88.68
C00011611 3-O-Methylsenecioodontol 86.79
C00011614 3-O-Methyl-2,5-dehydrosenecioodontol 86.79
C00020077 [1S-[1alpha,2alpha(Z),4beta]]-1,2,3,4-Tetrahydro-7-methoxy-1,6-dimethyl-4-(1-methylethyl)-2-naphthalenyl ester 2-methyl-2-butenoic acid 86.79
C00045150 1',2'-Epoxy-3',4'-di-isobutyryl-Z-coniferyl alcohol 86.79
C00029686 Angelol B 85.45
C00012119 15-Deoxybudlein A
Atripliciolide angelate		 85.19
C00010831 Diester with 4-(1,2-epoxy-1-methylethyl)-3-hydroxybenzyl alc. isobutyric acid 84.91
C00011841 Vicolide B 84.91
C00012263 Gigantanolide A 84.91
C00012264 Gigantanolide B 84.91
C00012419 Pycnolide 84.91
C00017316 [1aR-(1aalpha,4alpha,4abeta,5beta,9aS*)]-1a,2,4,4a,5,9-hexahydro-4-hydroxy-4,4a,6-trimethyl-9-oxo-3H-oxireno[8,8a]naphtho[2,3-b]furan-5-yl ester 2-methyl-propanoic acid 84.91
C00023269 2-Senecioyl-4-[1-(4'-acetoxyangeloyloxyethyl)]-phenol 84.91
C00020462 Solidaginoide B 83.93
C00019824 Cyclohoehnelia coumarin 83.64
C00045667 Artekeiskeanol C 83.64
C00045668 Artekeiskeanol D 83.64
C00000168 1beta,10alpha-Epoxy-8beta,14-dihydroxy-4E,11(13)-germacradien-12,6-olide 83.33
C00012114 Ladibranolide 83.33
C00020565 5-Desoxypumilim 83.33
C00042506 Eupakirunsin D
(-)-Eupakirunsin D		 83.33
C00045935 Ferupennin D
(-)-Ferupennin D		 83.33
C00002119 Senkirkine 83.02
C00003330 Microhelenin C 83.02
C00012265 Gigantanolide C 83.02
C00015458 [3S-(3R*,8R*,9R*,11E)]-3,4,5,6,9,10-Hexahydro-8,9,16-trihydroxy-14-methoxy-3-methyl-1H-2-benzoxacyclotetradecin-1,7(8H)-dione
L 783278
LL-Z 1640-1		 83.02
C00017377 ,[1aR-[1aalpha,3alpha(Z),4beta,4abeta,5beta,9alphaS*]]-1a,2,4,4a,5,9-Hexahydro-5-hydroxy-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan-3-yl ester 2-methyl-2-butenoic acid 83.02
C00017408 Ligucalthaefolin 83.02
C00019180 Kushecarpin C
(6S,6aS,11aR,11bS)-3-Keto-11b-hydroxy-8,9-dimethoxy-1,2-dihydropterocarpan		 83.02
C00019898 4-[4-Hydroxy-6-epi-hydroperoxy-7,9-dehydro-6,7-dihydrogeranyloxy]-5-methylcoumarin 83.02
C00019911 4-[4-Hydroxy-6-hydroperoxy-7,9-dehydro-6,7-dihydrogeranyloxy]-5-methylcoumarin 83.02
C00020076 [1R-[1alpha,2beta(Z),4alpha]]-1,2,3,4-Tetrahydro-7-hydroxy-1,6-dimethyl-4-(1-methylethyl)-2-naphthalenyl ester 2-methyl-2-butenoic acid 83.02
C00023619 Aflatoxin G2 83.02
C00030935 Pd-C-I 83.02
C00034603 Methylmelicopol 83.02
C00042178 8,10-Epoxy-9-acetoxythymol angelate 83.02
C00047566 Scuteflorin B
(+)-Scuteflorin B		 83.02
C00049405 Tomenphantin B 83.02
C00045023 Polygalolide A
(-)-Polygalolide A		 82.14
C00012316 [3aS-[3aR*,4R*(Z),5R*,6R*,10E,11aS*]]-2,3,3a,4,5,6,7,8,9,11a-Decahydro-5,6-dihydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca[b]furan-4-yl ester 2-methyl-2-butenoic acid 81.82
C00012418 Trichogoniolide 81.82
C00020962 4-O-Tigloyl-11,13-dihydroautumnolide 81.82
C00041292 7-Methoxyrosmanol
(+)-7-Methoxyrosmanol		 81.82
C00041502 Didymochlaenone B 81.82
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