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


and

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




INPUT WORD = C00012544 , 50% or more
[ Metabolite Name : (S)-4-Hydroxy-3-(1,2,2-trimethylcyclopentyl)benzaldehyde , (-)-alpha-Formylherbertenol ]
Number of matched data : 76

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00036367 1,15-Dihydroxyherbertene 97.14
C00012546 Herbertenolide
(3aS-trans)-2,3,3a,9b-Tetrahydro-3a,8,9b-trimethylcyclopenta[c][1]benzopyran-4(1H)-one		 94.44
C00012543 (-)-alpha-Herbertenol
alpha-Herbertenol
4-Hydroxyisocuparene
(S)-4-Methyl-2-(1,2,2-trimethylcyclopentyl)phenol		 94.29
C00012545 (-)-Herbertenediol
Herbertenediol(S)-5-Methyl-3-(1,2,2-trimethylcyclopentyl)-1,2-benzenediol		 94.29
C00035991 (-)-Herbertene-1,12-diol 94.29
C00036366 1,13-Dihydroxyherbertene 94.29
C00011636 Sydonol 91.67
C00011901 ar-Pseudotsugonal
(R)-4-(1,5-Dimethyl-3-oxohexyl)-benzaldehyde		 91.43
C00011943 Himaphenolone
Himasecolone		 91.43
C00012509 gamma-Cuparenol 91.43
C00012512 2,3-Dihydroxycuparene
(S)-3-Methyl-6-(1,2,2-trimethylcyclopentyl)-1,2-benzenediol		 91.43
C00012533 Cuparenic acid 91.43
C00049539 Thalictroidine 91.43
C00012564 (+)-2-(Bromomethyl)-2,3,4,5-tetrahydro-5,8,10-trimethyl-2,5-methano-1-benzoxepin 88.89
C00049253 Parahigginol D
(-)-Parahigginol D		 88.89
C00011635 (+)-Curcudiol
(S)-(+)-Curcudiol
Curcudiol		 88.57
C00011668 (S)-(+)-Elvirol 88.57
C00012537 [1S-(1alpha,2beta,5alpha)]-2-(1,2-Dimethylbicyclo[3.1.0]hex-2-yl)-5-methylphenol
Debromolaurinterol		 88.57
C00012541 (-)-Herbertene
(-)-Isocuparene
Herbertene
Isocuparene
(S)-1-Methyl-3-(1,2,2-trimethylcyclopentyl)benzene		 88.57
C00012552 (-)-Debromoaplysin
Debromoaplysin
[3S-(3alpha,3abeta,8bbeta)]-2,3,3alpha,8beta-tetrahydro-3,3alpha,6,8beta-tetramethyl-1H-cyclopenta[b]benzofuran		 88.57
C00012580 Laurenisol 88.57
C00015013 Bhimanone 88.57
C00021314 Podocephalol 88.57
C00035990 (-)-gamma-Herbertenol 88.57
C00037264 Herbertenone A
(-)-Herbertenone A		 88.57
C00042680 Laur-11-en-1,10-diol
(-)-Laur-11-en-1,10-diol		 88.57
C00046403 Sesquichamaenol 88.57
C00049250 Parahigginol A
(-)-Parahigginol A		 88.57
C00011665 Sydnic acid
Sydonic acid		 86.84
C00012561 (2alpha,5beta,10S*)-(-)-7-bromo-4,5-dihydro-5,8,10-trimethyl-2,5-methano-1-benzoxepin-2(3H)-methanol
Filiforminol		 86.84
C00020158 Ryomenin 86.84
C00045887 Enokipodin A
(+)-Enokipodin A		 86.84
C00012524 Deoxyhelicobasidin 86.49
C00020075 5-Hydroxy-8-methoxycalamenene 86.49
C00020168 3,5-Dihydro-8-hydroxy-5-isopropyl-2,7-dimethyl-1-benzoxepin-4(2H)-one 86.49
C00020185 (1S,4S)-7-Methoxycalamenen-3-one 86.49
C00020773 (1S,4R)-7-Methoxycalamenen-4-ol 86.49
C00011900 (+/-)-ar-Todomatuic acid
ar-Todomatuic acid
(R)-4-(1,5-Dimethyl-3-oxohexyl)benzoic acid		 86.11
C00012538 [1S-(1alpha,2beta,5alpha)]-2-Bromo-6-(1,2-dimethylbicyclo[3.1.0]hex-2-yl)-3-methylphenol
Neolaurinterol		 86.11
C00012540 [1S-(1alpha,2beta,5alpha)]-2-(1,2-Dimethylbicyclo[3.1.0]hex-2-yl)-5-methyl-2,5-cyclohexadiene-1,4-dione
(-)-Laurequinone
Laurequinone		 86.11
C00012551 [3S-(3alpha,3abeta,8bbeta)]-7-Bromo-2,3,3a,8b-tetrahydro-3,3a,6,8b-tetramethyl-1H-cyclopenta[b]benzofuran
Aplysin (7CI)
(-)-Aplysin
Aplysin		 86.11
C00012555 Isoaplysin
[3S-(3alpha,3abeta,8bbeta)]-3a-(Bromomethyl)-2,3,3a,8b-tetrahydro-3,6,8b-trimethyl-1H-cyclopenta[b]benzofuran		 86.11
C00012560 [2S-(2alpha,5alpha,10S*)]-7-Bromo-2,3,4,5-tetrahydro-2,5,8,10-tetramethyl-2,5-methano-1-benzoxepin
(-)-Filiformin
Filiformin		 86.11
C00021114 2-(2-Hydroxy-4-methylphenyl)-3-(2-methylpropoxy)-1,2-propanediol 86.11
C00035446 [4]-Shogaol 86.11
C00002996 (+)-8-Hydroxycalamenene 85.71
C00011537 (+)-Myomontanone 85.71
C00012505 (1alpha,3beta,5beta)-(-)-2-(3-Bromo-2,2,5-trimethylcyclopentyl)-5-methylphenol 85.71
C00012511 (-)-delta-Cuparenol
(S)-2-Hydroxycuparene
delta-Cuparenol
Cuparophenol
(S)-2-Methyl-5-(1,2,2-trimethylcyclopentyl)phenol		 85.71
C00012514 alpha-Isocuparenol 85.71
C00012515 alpha-Cuparenol 85.71
C00012542 (-)-beta-Herbertenol
beta-Herbertenol
2-Hydroxyisocuparene
(S)-2-Methyl-4-(1,2,2-trimethylcyclopentyl)phenol		 85.71
C00012567 cis-(-)-2-[2-(Bromomethylene)-1,3-dimethylcyclopentyl]-5-methylphenol
(-)-Isolaurenisol
Isolaurenisol		 85.71
C00012570 (1R-cis)-4-(1,2-Dimethyl-3-methylenecyclopentyl)benzenemethanol
Laurenol		 85.71
C00012572 (1R-cis)-4-(1,2-Dimethyl-3-methylenecyclopentyl)benzaldehyde
Laurenal		 85.71
C00012576 (1R-cis)-4-(1,2-Dimethyl-3-methylenecyclopentyl)-1,4-cyclohexadiene-1-methanol
Isodihydrolaurenol		 85.71
C00012577 (1R-cis)-2-(1,2-Dimethyl-3-methylenecyclopentyl)-5-methylphenol
7-Hydroxylaurene
Debromoallolaurinterol		 85.71
C00013228 Liguhodgsonal
(R)-5,6,7,8-Tetrahydro-3-hydroxy-7-(1-methylethenyl)-1-naphthalenecarboxaldehyde		 85.71
C00020061 1,9-Cadinadien-3-one 85.71
C00020174 (1S,3R,4S)-Calamenene-3,7-diol 85.71
C00020177 3-Hydroxy-8-calamenenone
(1S,4R)-7-Hydroxycalamenen-3-one		 85.71
C00021942 Pallescensin C 85.71
C00024216 Mysorenone B 85.71
C00030610 Kikkanol B
(-)-Kikkanol B		 85.71
C00032432 Turmeronol B
(+)-Turmeronol B		 85.71
C00032696 Acetovanillochromene 85.71
C00037265 Herbertenone B
(-)-Herbertenone B		 85.71
C00042034 10-epi-7,10-epoxy-ar-bisabol-11-ol 85.71
C00042167 7,10-Epoxy-ar-bisabol-11-ol 85.71
C00042434 Cyclolauren-2-ol
(+)-Cyclolauren-2-ol		 85.71
C00042682 Laur-11-en-2,10-diol 85.71
C00043014 Sohirnone A 85.71
C00044509 Ainigmaptilone B
(-)-Ainigmaptilone B		 85.71
C00045546 2-Methoxy-6-heptyl-1,4-benzoquinone 85.71
C00050106 Gibbilimbol A 85.71
C00050107 Gibbilimbol B 85.71
Page Top