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


and

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




INPUT WORD = C00010836 , 50% or more
[ Metabolite Name : (E)-2-Methyl-4-methoxy-5-methyl-2-[2-[(2-methyl-1-oxopropoxy)methyl]oxiranyl]phenyl ester ]
Number of matched data : 83

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
C00010835 (E)-2-Methyl-[2-[5-methoxy-4-methyl-2-(2-methyl-1-oxopropoxy)phenyl]oxiranyl]methyl ester 92.45
C00010837 2-Methyl-2-[2-[(acetyloxy)methyl]oxiranyl]-4-methoxy-5-methylphenyl ester 92.45
C00011611 3-O-Methylsenecioodontol 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
C00011614 3-O-Methyl-2,5-dehydrosenecioodontol 86.79
C00045150 1',2'-Epoxy-3',4'-di-isobutyryl-Z-coniferyl alcohol 86.79
C00011612 2,5-Di-O-methylsenecioodontol 85.19
C00010831 Diester with 4-(1,2-epoxy-1-methylethyl)-3-hydroxybenzyl alc. isobutyric acid 84.91
C00010832 2-Methyl-4-(1,2-epoxy-1-methylethyl)-3-hydroxybenzyl ester isobutyrate 84.91
C00017388 1a,2,4,4a,5,9-Hexahydro-4-hydroxy-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan-5-yl ester 2-methyl-2-butenoic acid 84.91
C00017430 6beta-Angeloyloxy-1,10b-epoxy-9-oxofuranoeremophilane 84.91
C00042178 8,10-Epoxy-9-acetoxythymol angelate 84.91
C00045019 Pochonin C 84.91
C00011984 [3aS-[3aalpha,4beta(Z),5beta,6alpha,7alpha,7abeta]]- 6-Ethenyl-5-(1-formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-butenoic acid 83.02
C00011992 Zinaflorin V 83.02
C00012052 [3aR-[3aalpha,4alpha(Z),5beta,6alpha,7alpha,7aalpha]]- 6-Ethenyloctahydro-3a,5-dihydroxy-6-methyl-3-methylene-7-(1-methylethenyl)-2-oxo-4-benzofuranyl ester 2-methyl-2-butenoic acid 83.02
C00015456 L 783277 83.02
C00015457 L 783290 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
C00015459 F 152
L 783279		 83.02
C00017309 [4S-[4alpha(E),4aalpha,5alpha,8beta,8abeta]]-4,4a,5,6,7,8,8a,9-Octahydro-8-hydroxy-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid 83.02
C00017314 [4S-[4alpha(Z),4aalpha,5alpha,6alpha]]-4,4a,5,6,7,9-Hexahydro-6-hydroxy-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid 83.02
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 83.02
C00017432 [1aR-(1aalpha,4beta,4abeta,5beta,9aS*)]-1a,2,4,4a,5,9-Hexahydro-4,4a,6-trimethyl-9-oxo-3H-oxireno[8,8a]naphtho[2,3-b]furan-5-yl ester 3-methyl-2-butenoic acid 83.02
C00041020 Junipediol A 8-glucoside 83.02
C00041021 Junipediol B 8-glucoside 83.02
C00045339 CID is old! 83.02
C00049200 Leptin F
(+)-Leptin F		 83.02
C00041292 7-Methoxyrosmanol
(+)-7-Methoxyrosmanol		 81.82
C00000168 1beta,10alpha-Epoxy-8beta,14-dihydroxy-4E,11(13)-germacradien-12,6-olide 81.48
C00000235 Heliangine 81.48
C00008745 3,5,7,4'-Tetrahydroxy-3'-methoxyflavanone 3-acetate 81.48
C00011867 (Z,Z)-Heliangin
Leptocarpin		 81.48
C00011871 Cordifolia 54 81.48
C00012027 (+)-Zinaflavin B
Zinaflavin B		 81.48
C00012956 Tanapsin
[3aR-[3aalpha,4alpha(Z),4aalpha,5beta,8beta,8abeta,9abeta]]-Dodecahydro-5,8-dihydroxy-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid		 81.48
C00020957 3-O-Angeloylcarolenalone 81.48
C00020958 3-O-Tigloylcarolenalone 81.48
C00039365 Helivypolide D 81.48
C00042125 3-epi-Heliangin
(-)-3-epi-Heliangin		 81.48
C00046288 Patientoside B
(-)-Patientoside B		 81.48
C00003034 Cinerin II 81.13
C00011846 Trichomoriolide 81.13
C00011851 Acanthospermolide 81.13
C00011985 [3aS-[3aalpha,4beta,5beta,6alpha,7alpha(Z),7abeta]]- 6-Ethenyl-5-(1-formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-2-oxo-7-benzofuranyl ester 2-methyl-2-butenoic acid 81.13
C00011998 [3aR-[3aalpha,4beta(Z),6alpha,7beta,7abeta]]-6-Ethenyloctahydro-6-methyl-a,3-bis(methylene)-4-[(2-methyl-1-oxo-2-butenyl)oxy]-2-oxo-7-benzofuranacetic acid 81.13
C00011999 [3aR-[3aalpha,4beta(E),6alpha,7beta,7abeta]]-6-ethenyloctahydro-6-methyl-a,3-bis(methylene)-4-[(2-methyl-1-oxo-2-butenyl)oxy]-2-oxo-7-benzofuranacetic acid 81.13
C00012117 15-Deoxygayazensolide 81.13
C00012265 Gigantanolide C 81.13
C00012268 (+)-Jurinelloide
Jurinelloide		 81.13
C00017358 [4S-[4alpha(Z),4aalpha,5alpha,8aalpha]]-4,4a,5,6,7,8,8a,9-Octahydro-8a-hydroxy-3,4a,5-trimethylnaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid 81.13
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 81.13
C00017392 [1aS-[1aalpha,4alpha,4aalpha,5alpha(Z),9aS*]]-1a,2,4,4a,5,9-Hexahydro-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan-5-yl ester 2-methyl-2-butenoic acid 81.13
C00017393 Senemorin 81.13
C00018664 Mitomycin B 81.13
C00019180 Kushecarpin C
(6S,6aS,11aR,11bS)-3-Keto-11b-hydroxy-8,9-dimethoxy-1,2-dihydropterocarpan		 81.13
C00019914 4-[10-Hydroxy-7-hydroperoxy-5,6E-dehydro-6,7-dihydrogeranyloxy]-5-methylcoumarin 81.13
C00020898 Hymenoratin F 81.13
C00020899 2-O-Tigloylhymenoratin E 81.13
C00020900 Hymenoratin E 81.13
C00023191 8beta-Tigloyloxy-3beta,14-dihydroxy-6betaH,7alphaH-germacra-1(10)Z,4E-11(13)-trien-6,12-olide 81.13
C00023367 Isodihydroclutiolide 81.13
C00024292 Endolobine 81.13
C00026217 Neosenkirkine 81.13
C00030193 Epirosmanol 81.13
C00032282 Taiwaniaquinone F
(-)-Taiwaniaquinone F		 81.13
C00033531 15-epi-(4E)-jatrogrossidentadione 81.13
C00033835 Estafiatin 8-O-angelate 81.13
C00034561 Japodagrone 81.13
C00039193 Excavatin K
(+)-Excavatin K		 81.13
C00040318 Sinularolide B
(-)-Sinularolide B		 81.13
C00040477 Teuvincenone F 81.13
C00040555 Trigonochinene A
(+)-Trigonochinene A		 81.13
C00040556 Trigonochinene B
(-)-Trigonochinene B		 81.13
C00041340 Angulifolide
(-)-Angulifolide		 81.13
C00042502 Eupaheliangolide A
(-)-Eupaheliangolide A		 81.13
C00043197 3'-O-Acetylisopteleflorine
(+)-3'-O-Acetylisopteleflorine		 81.13
C00049202 Leptin H
(+)-Leptin H		 81.13
C00049486 Morinin D 81.13
C00049487 Morinin E 81.13
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