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


and

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





INPUT WORD = C00010985 , 50% or more
[ Metabolite Name : 1,1,5-Trimethyl-2-formyl-4-(E)-3-hydroxymethyl-2-butenoyloxy)-2,5-cyclohexadiene ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010986 1,1,5-Trimethyl-2-formyl-4-(3-methyl-2-butenoyloxy)-2,5-cyclohexadiene 92.11
C00010994 1,1,5-Trimethyl-2-formyl-6-((E)-3-hydroxymethyl-2-butenoyloxy)-2,4-cyclohexadiene 92.11
C00010982 3-Hydroxy-4,6,6-trimethyl-1,4-Cyclohexadiene-1-carboxaldehyde 2-methylcrotonate 89.47
C00042889 Pulicanone 86.84
C00010984 3-Hydroxy-4,6,6-trimethyl-1,4-Cyclohexadiene-1-carboxaldehyde 4-hydroxy-3-methylcrotonate acetate 86.36
C00046627 Asperic acid
(+)-Asperic acid
85.00
C00011760 Lactulide A 84.62
C00011824 [3S-(3R*,3aR*,5R*,6E,10Z,11aS*)]-3a,4,5,8,9,11a-Hexahydro-5-hydroxy-10-(hydroxymethyl)-3,6-dimethylcyclodeca[b]furan-2(3H)-one 84.62
C00012526 Lagopodin B 84.62
C00021574 Norbotryal acetate 84.62
C00039348 Hebelophyllene C
(+)-Hebelophyllene C
84.62
C00011398 Kobusimin A 84.21
C00011700 (+)-Epoxypuliglene
Epoxypuliglene
84.21
C00011725 [1S-(1R*,5E,7R*)]-4,10-bis(methylene)-7-(1-methylethyl)-5-Cyclodecen-1-ol acetate 84.21
C00013055 11,13-Dihydroarbusculin A
Colartin
[3S-(3alpha,3aalpha,5abeta,9alpha,9aalpha,9bbeta)]-Decahydro-9-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one
84.21
C00029609 9alpha-Hydroxyfraxinellone 84.21
C00010983 3-Hydroxy-4,6,6-trimethyl-1,4-Cyclohexadiene-1-carboxaldehyde 2-(hydroxymethyl)crotonate acetate 84.09
C00047971 Linderagalactone B
(-)-Linderagalactone B
83.33
C00003221 (-)-Artemisin
8-Hydroxysantonin
[3S-(3alpha,3aalpha,4alpha,5abeta,9bbeta)]-3a,5,5a,9b-Tetrahydro-4-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione
82.50
C00003297 Grosshemin 82.50
C00010965 [1S-[1alpha(E),5beta,6beta]]-5-hydroxy-3-(hydroxymethyl)-6-(1-methylethyl)-2-oxo-3-cyclohexen-1-yl ester 82.50
C00012111 2alpha-Hydroxydihydroparthenolide 82.50
C00012112 3beta-Hydroxy-11alpha,13-dihydroparthenolide 82.50
C00012996 Rothin B
[3aR-(3aalpha,4alpha,5abeta,9aalpha,9bbeta)]-Decahydro-4,9a-dihydroxy-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one
82.50
C00013019 Grangolide
[3R-(3alpha,3abeta,5aalpha,8beta,9bbeta)]-3a,4,5,5a,6,7,8,9b-Octahydro-3a,8-dihydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one
82.50
C00017769 (-)-Pereniporin B
Pereniporin B
82.50
C00020259 6alpha,7beta-Dihydroxydiihydrodrimenin 82.50
C00020488 Rupicolin A 82.50
C00020514 Integrifolin 82.50
C00020756 Dendocarbin G 82.50
C00020960 11,13-Dehydrocarolenalin 82.50
C00021007 Isolipidiol 82.50
C00021133 Deacetylconfertiflorin 82.50
C00033116 Lindenanolide E
(-)-Lindenanolide E
82.50
C00040764 12-Acetoxyisocomene
(-)-12-Acetoxyisocomene
82.50
C00045198 9beta-Hydroxyparthenolide 82.50
C00046844 Parthenolid-9-one
(-)-Parthenolid-9-one
82.50
C00011753 1alpha,3beta-Dihydroxy-4Z,9Z-germacradien-12,6alpha-olide 82.05
C00011758 (+)-Herbolide F
Herbolide F
82.05
C00011801 Tatridin A
Tavulin
82.05
C00012219 (-)-Ixerin A
Ixerin A
82.05
C00012337 [3R-(3R*,3aS*,4R*,5E,9E,11aS*)]-2,3,3a,4,7,8,11,11a-Octahydro-4-hydroxy-3,6-dimethyl-2-oxocyclodeca[b]furan-10-carboxaldehyde
6alpha-Hydroxy-14-oxo-1(10)E,4E,germacradien-12,8alpha-olide
82.05
C00012382 Frutescinic acid 82.05
C00012523 (S)-2,5-Dihydroxy-3-methyl-6-(1,2,2-trimethylcyclopentyl)-2,5-cyclohexadiene-1,4-dione
Helicobasidin
82.05
C00012876 Ursialpinolide
[1aR-(1aalpha,3aalpha,4abeta,7abeta,8abeta,8balpha)]-1a,4,4a,7,7a,8,8a,8b-Octahydro-3a,8b-dimethyl-7-methyleneoxireno[5,6]naphtho[2,3-b]furan-6(3aH)-one
82.05
C00013197 Ivangulinic acid
[3aR-[3aalpha,5(S*),7aalpha]]-2,3,3a,4,7,7a-Hexahydro-gamma,6-dimethyl-3-methylene-2-oxo-5-benzofuranbutanoic acid
82.05
C00016960 Ratibinolide
Ratibinolide I
82.05
C00020143 Pernetic acid A methyl ester 82.05
C00021043 Ivambrin 82.05
C00030729 Mansonone O
(-)-Mansonone O
82.05
C00037301 Integrifonol A
(+)-Integrifonol A
82.05
C00046123 Mansonone Q
(+)-Mansonone Q
82.05
C00048224 Ustusol A
(-)-Ustusol A
82.05
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