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


and

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




INPUT WORD = C00046867 , 50% or more
[ Metabolite Name : Puertitol B acetate ]
Number of matched data : 72

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00011429 (+)-9-Acetoxynerolidol 90.48
C00011703 Tanacetol B 90.48
C00011704 (-)-Tanacetol A
Tanacetol A		 90.48
C00046594 9-Acetylisoobtusol
(+)-9-Acetylisoobtusol		 88.89
C00011432 [3R-(3R*,5S*,6E,9S*)]-3,7,11-trimethyl-1,6,10-dodecatriene-3,5,9-triol 9-acetate 88.10
C00021088 5-Acetoxynerolidol 88.10
C00042880 Pulicanadienal B
(+)-Pulicanadienal B		 88.10
C00012070 Shiromodiol monoacetate 86.05
C00022065 13-Ketogeranylgeraniol
Eleganolone		 86.05
C00022066 Eleganonal 86.05
C00022067 Isoeleganonal 86.05
C00022086 13-Hydroxygeranyllinalol 86.05
C00022089 13-Oxogeranyllinalol 86.05
C00022091 Crinitol 86.05
C00039299 Guai-6-ene 86.05
C00003105 Buddledin A 85.71
C00011916 Puertitol B 85.71
C00012428 [1S-(1R*,2E,4R*,5R*,6E,10R*)]-3,7,11,11-Tetramethylbicyclo[8.1.0]undeca-2,6-diene-4,5-diol 4-acetate 85.71
C00017513 Fauronyl acetate 85.71
C00021263 Plagiochiline H 85.71
C00022150 4-[3-(4,8-Dimethyl-3,7-nonadienyl)-3-methyloxiranyl]-2-butanone 85.71
C00030613 Kikkanol D monoacetate
(-)-Kikkanol D monoacetate		 85.71
C00030616 Kikkanol F monoacetate
(-)-Kikkanol F monoacetate		 85.71
C00046097 Luzonensol acetate 85.71
C00047245 Helenynolic acid 85.71
C00048303 9-Hydroxy-(10E,12Z,15Z)-octadecatrienoic acid 85.71
C00050320 3-Acetoxy-E-gamma-Bisabolene 85.71
C00022038 (E,E,E)-1,7-Dihydroxy-2,5,10,14-phytatetraen-13-one 84.44
C00021023 15-Acetoxy-11beta,13-dihydroziniolide 84.09
C00021695 Acetylivalin 84.09
C00010374 3,3,6-Trimethyl-5-heptene-1,2,4-triol 83.72
C00012185 Novanin 83.72
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
C00012686 Austradiol acetate
[1R-(1a,4beta,4abeta,7alpha,8alpha,8aalpha)]-4-Bromodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1,8-naphthalenediol 8-acetate		 83.72
C00020354 Cyclokessyl acetate 83.72
C00020387 8alpha-Acetoxydolichlasin 83.72
C00021594 11-Acetoxy-2-bromo-3-hydroxy-beta-chamigrene 83.72
C00022055 (3Z,5E,10E)-7-Hydroxy-13-keto-3,7,11,15-tetramethylhexadeca-1,3,5,10,14-pentaene 83.72
C00022080 (E,E,E)-2,6,10,14-Tetramethyl-3,6,10,15-hexadecatetraene-2,14-diol 83.72
C00022085 9-Hydroxygeranyllinalol 83.72
C00042186 Acetylelatol 83.72
C00049719 Epoxycembrene A 83.72
C00000344 alpha-Cycloheptaneundecanoic acid 83.33
C00000345 omega-Cycloheptylundecanoic acid 83.33
C00001232 Oleic acid
(Z)-9-Octadecenoic acid		 83.33
C00001235 Petroselinic acid 83.33
C00001239 Sterculic acid 83.33
C00001278 Crepenynic acid 83.33
C00007439 18-Hydroxy-9-octadecenoic acid 83.33
C00011659 Acetoxydelobanone 83.33
C00012427 [1S-(1R*,2E,4R*,5R*,6E,10R*)]-3,7,11,11-Tetramethylbicyclo[8.1.0]undeca-2,6-diene-4,5-diol 5-acetate 83.33
C00012735 [1S-(1alpha,2beta,4abeta,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-2-(1-methylethenyl)-1-naphthalenol acetate 83.33
C00012751 Coralloidin A
[2R-(2alpha,5beta,8aalpha)]-1,2,3,5,6,7,8,8a-Octahydro-5,8a-dimethyl-3-(1-methylethylidene)-2-naphthalenol acetate		 83.33
C00017013 [1R-(1alpha,4aalpha,5alpha)]- 1-(Acetyloxy)-3,4,4a,5,6,7-hexahydro-4a,5-dimethyl-3-(1-methylethylidene)-2(1H)-naphthalenone 83.33
C00017057 (Z,E,E,E)-5-(2,4,6-Tetradecatriene-8,10-diynylidene)-2(5H)-furanone
Dihydroxerulin		 83.33
C00017058 (Z,E,E,E,E)-5-(2,4,6,12-Tetradecatetraene-8,10-diynylidene)-2(5H)-furanone
Xerulin		 83.33
C00020363 Liguloxidol acetate 83.33
C00020406 11-Acetoxy-10(14)-guaien-4alpha-ol 83.33
C00021235 9beta-Acetoxy-10(14)-aromadendren-4beta-ol 83.33
C00021889 1-Acetoxy-3,15-epoxygymnomitrane 83.33
C00022109 Geranyllinalool
(E,E)-Geranyllinalool
geranyllinalool		 83.33
C00022195 Isotrixagol 83.33
C00023371 Helipterol 83.33
C00031505 15-Acetoxy-T-muurolol 83.33
C00031661 Chabrolol A
(+)-Chabrolol A		 83.33
C00037348 Itomanallene B 83.33
C00045480 (+)-Nephthenol 83.33
C00045631 Alseodafuranone
(-)-Alseodafuranone		 83.33
C00045999 Hedaol A
(-)-Hedaol A		 83.33
C00046000 Hedaol B
(-)-Hedaol B		 83.33
C00047621 (2E,4E,8E,10E)-Heptadecatetraen-6-yn-1-yn acetate 83.33
C00049734 Nephthenol
(-)-Nephthenol		 83.33
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