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


and

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




INPUT WORD = C00012513 , 50% or more
[ Metabolite Name : (S)-2,2,3-Trimethyl-3-(4-methylphenyl)cyclopentanone , Cyclopentanone, 2,2,3-trimethyl-3-p-tolyl-, (S)-(+)- , (+)-alpha-Cuparenone , (+)-Cuparenone , alpha-Cuparenone ]
Number of matched data : 61

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00040139 R-(-)-alpha-Cuparenone
(-)-R-(-)-alpha-Cuparenone		 100.00
C00012514 alpha-Isocuparenol 96.97
C00012515 alpha-Cuparenol 96.97
C00012516 (+)-beta-Cuparenone
beta-Cuparenone
beta-Cuparenone		 96.97
C00011626 2-Methyl-6-(4-methylphenyl)-1-hepten-3-one
1,3,5,11-Bisabolatetraen-10-one		 93.94
C00011627 1,3,5-Bisabolatrien-10-one
2-Methyl-6-(4-methylphenyl)-3-heptanone		 93.94
C00012504 alpha-bromocuparane
alpha-Bromocuparene
Bromocuparene
(1S-trans)-1-(3-Bromo-1,2,2-trimethylcyclopentyl)-4-methylbenzene		 93.94
C00042681 Laur-11-en-10-ol
(-)-Laur-11-en-10-ol		 93.94
C00012537 [1S-(1alpha,2beta,5alpha)]-2-(1,2-Dimethylbicyclo[3.1.0]hex-2-yl)-5-methylphenol
Debromolaurinterol		 91.18
C00011623 (+-)-(E)-Nuciferol
(+-)-Nuciferol		 90.91
C00011624 (+)-Nuciferal
(E)-Nuciferal
(E,S)-(+)-Nuciferal		 90.91
C00012508 (+)-Cuparene
Cuparene
(R)-1-Methyl-4-(1,2,2-trimethylcyclopentyl)-benzene
(R)-Cuparene		 90.91
C00012509 gamma-Cuparenol 90.91
C00012510 (-)-Cuparene
(S)-1-Methyl-4-(1,2,2-trimethylcyclopentyl)benzene
(S)-(-)-Cuparene		 90.91
C00012511 (-)-delta-Cuparenol
(S)-2-Hydroxycuparene
delta-Cuparenol
Cuparophenol
(S)-2-Methyl-5-(1,2,2-trimethylcyclopentyl)phenol		 90.91
C00012529 gamma-Cuprenene
4-Cuprenene
Buprenene IV		 90.91
C00012534 Cyclolaurene
[1S-(1alpha,2beta,5alpha)]-1,2-Dimethyl-2-(4-methylphenyl)bicyclo[3.1.0]hexane		 90.91
C00012569 (1R,2S)-(+)-p-(1,2-Dimethyl-3-methylenecyclopentyl)toluene
(+)-Laurene		 90.91
C00012570 (1R-cis)-4-(1,2-Dimethyl-3-methylenecyclopentyl)benzenemethanol
Laurenol		 90.91
C00012572 (1R-cis)-4-(1,2-Dimethyl-3-methylenecyclopentyl)benzaldehyde
Laurenal		 90.91
C00012575 (1R-cis)-1-(1,2-dimethyl-3-methylenecyclopentyl)-4-methyl-1,4-Cyclohexadiene
Isodihydrolaurene		 90.91
C00012576 (1R-cis)-4-(1,2-Dimethyl-3-methylenecyclopentyl)-1,4-cyclohexadiene-1-methanol
Isodihydrolaurenol		 90.91
C00020070 gamma-Calacorene 90.91
C00021314 Podocephalol 90.91
C00045888 Enokipodin B
(-)-Enokipodin B		 89.19
C00012506 Cupalaurenol
(R)-4-Bromo-2-methyl-5-(1,2,2-trimethyl-3-cyclopenten-1-yl)phenol		 88.57
C00012512 2,3-Dihydroxycuparene
(S)-3-Methyl-6-(1,2,2-trimethylcyclopentyl)-1,2-benzenediol		 88.57
C00042034 10-epi-7,10-epoxy-ar-bisabol-11-ol 88.57
C00042167 7,10-Epoxy-ar-bisabol-11-ol 88.57
C00042680 Laur-11-en-1,10-diol
(-)-Laur-11-en-1,10-diol		 88.57
C00042682 Laur-11-en-2,10-diol 88.57
C00011901 ar-Pseudotsugonal
(R)-4-(1,5-Dimethyl-3-oxohexyl)-benzaldehyde		 88.24
C00012552 (-)-Debromoaplysin
Debromoaplysin
[3S-(3alpha,3abeta,8bbeta)]-2,3,3alpha,8beta-tetrahydro-3,3alpha,6,8beta-tetramethyl-1H-cyclopenta[b]benzofuran		 88.24
C00042434 Cyclolauren-2-ol
(+)-Cyclolauren-2-ol		 88.24
C00049250 Parahigginol A
(-)-Parahigginol A		 88.24
C00002996 (+)-8-Hydroxycalamenene 87.88
C00011618 Iso-alpha-curcumene 87.88
C00011620 (-)-Curcuphenol
(R)-(-)-Curcuphenol
(R)-Curcuphenol
Curcuphenol		 87.88
C00011621 (+)-Curcuphenol
(S)-(+)-Curcuphenol
(S)-Curcuphenol		 87.88
C00011625 (+)-ar-Turmerone
(S)-ar-Turmerone
ar-Tumerone		 87.88
C00011641 Turmerone
(S)-2-Methyl-6-(4-methyl-1,4-cyclohexadien-1-yl)-2-hepten-4-one		 87.88
C00012542 (-)-beta-Herbertenol
beta-Herbertenol
2-Hydroxyisocuparene
(S)-2-Methyl-4-(1,2,2-trimethylcyclopentyl)phenol		 87.88
C00012543 (-)-alpha-Herbertenol
alpha-Herbertenol
4-Hydroxyisocuparene
(S)-4-Methyl-2-(1,2,2-trimethylcyclopentyl)phenol		 87.88
C00012556 (1S-cis)-1-[3-(Bromomethyl)-1-methyl-2-methylenecyclopentyl]-4-methyl-1,4-cyclohexadiene
12-Bromo-4(13),6,9-lauratriene		 87.88
C00012557 (1R-cis)-1-[3-(Bromomethyl)-1-methyl-2-methylenecyclopentyl]-4-methylbenzene
12-Bromo-4(13),6,8,10-lauratetracene		 87.88
C00012566 (+)-Isolaurene 87.88
C00012573 (-)-Epilaurene
(1R-trans)-1-(1,2-Dimethyl-3-methylenecyclopentyl)-4-methylbenzene		 87.88
C00012577 (1R-cis)-2-(1,2-Dimethyl-3-methylenecyclopentyl)-5-methylphenol
7-Hydroxylaurene
Debromoallolaurinterol		 87.88
C00020069 3-Hydroxy-beta-calacorene 87.88
C00020072 (+)-Calamenene
(+)-cis-Calamenene		 87.88
C00020073 5-Hydroxycalamenene 87.88
C00020074 Calamenene
(-)-cis-Calamenene
L-Calamenene
(-)-Calamenene		 87.88
C00021313 ar-Himachalene 87.88
C00029766 Baccharisketone 87.88
C00029831 Bisacumol
(+)-Bisacumol		 87.88
C00035050 (+)-ar-Dihydroturmerone
ar-Dihydroturmerone		 87.88
C00035053 ar-Turmerol 87.88
C00035764 Tenuifolene
(-)-Tenuifolene		 87.88
C00036907 cis-Calamenene 87.88
C00037928 trans-Calamenene 87.88
C00050104 gamma-Dehydro-ar-himachalene 87.88
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