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


and

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




INPUT WORD = C00013225 , 50% or more
[ Metabolite Name : (4aS-trans)-4,4a,5,6,7,8-hexahydro-4a,8-dimethyl-2(3H)-Naphthalenone , (+)-(6S,10S)-6,10-Dimethylbicyclo[4.4.0]dec-1-en-3-one , (+)-(S,S)-6,10-Dimethylbicyclo[4.4.0]dec-1-en-3-one ]
Number of matched data : 64

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00032315 Teuhetenone A 93.10
C00017461 1alpha-Hydroxyisoondetianone 89.66
C00000319 Dihydroactinidiolide 88.89
C00001983 Tecomine 88.89
C00012026 Geijeron
Geijerone		 88.89
C00013224 (-)-Geosmin
Geosmin
[4S-(4alpha,4aalpha,8abeta)]-Octahydro-4,8a-dimethyl-4a(2H)-naphthalenol		 88.89
C00021926 7-Isopropyl-5-methylbicyclo[2.2.2]oct-5-en-2-one 88.89
C00046258 Oxyphyllenone A
(+)-Oxyphyllenone A		 87.10
C00046259 Oxyphyllenone B 87.10
C00019144 (-)-Loliolide
(6S,7alphaR)-Loliolide
Loliolide		 86.21
C00019146 (+)-Isololiolide
Isololiolide
(+)-epiloliolide		 86.21
C00010449 2-Bromo-4-chloro-1-(2-chloroethenyl)-1-methyl-5-methylenecyclohexane 85.19
C00010454 Plocamene D 85.19
C00013220 Cogeijerene
2,3,4,4a,5,6-Hexahydro-1,4a-dimethylnaphthalene		 85.19
C00021039 (+)-Isoclavukerin A 85.19
C00035459 11-Methyl-4-dodecanone 85.19
C00045569 4,9-Dimethyldecanoic acid 85.19
C00013221 Cybullol
2,[2S-(2alpha,4aalpha,5alpha,8abeta)]-Octahydro-5,8a-dimethyl-4a(2H)-naphthalenediol		 82.76
C00021957 2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-dien-8-ol 82.76
C00021958 2,2,6,7-Tetramethylbicyclo[4.3.0]nona-1(9),4-dien 82.76
C00032377 trans-Pinocarvyl acetate 82.76
C00038082 (+)-Loliolide 82.76
C00010452 Gelidene 82.14
C00010453 Mertensene 82.14
C00010469 trans-Acetate-1-methyl-2-(1-methylethenyl)-cyclobutaneethanol 82.14
C00011518 Chokol A
(-)-Chokol A		 82.14
C00021848 Nortricycloekasantalic acid
eka-Nortricyclosantalic acid		 82.14
C00028003 Calyxamine B 82.14
C00048350 Carvyl acetate 82.14
C00007679 (+)-Epilupinine-N-oxide
Epilupinine N-oxide		 81.48
C00010394 Cartilagineal 81.48
C00010398 8-Chloro-6-chloromethyl-2-methyl-2,6-octadien-1-ol 81.48
C00010429 2-Chloro-1hydroxy-3(8),5-ochtodien-4-one 81.48
C00010459 Plocamadiene A
2-Bromo-1-chloro-4-(2-chloroethenyl)-1-methyl-5-methylenecyclohexane		 81.48
C00010464 Plocamene E 81.48
C00010633 1-Methoxy-3-myodesertene
Myodesertin		 81.48
C00010636 Neonepetalactone 81.48
C00012025 Geijerene
Geijeren		 81.48
C00017464 11,12,13-Trinor-6,9-eremophiladien-8-one 81.48
C00020988 Clavukerin A 81.48
C00021250 Trinoranastreptene 81.48
C00021846 Norecasantalol 81.48
C00021847 Norecasantalal
eka-Nortricyclosantalal		 81.48
C00021855 Santalone 81.48
C00022646 7-Methoxy-1-methyltetralin 81.48
C00023640 Chokol G
3-(3-Hydroxy-2,3-dimethylcyclopentyl)but-3-en-1-ol
(-)-Chokol G		 81.48
C00029590 7-Methoxy-3,7-dimethyl-octanal 81.48
C00030152 1-Dodecanol
Dodecan-1-ol
Dodecanol		 81.48
C00030644 Lauraldehyde
Dodecanal		 81.48
C00031881 Incarvilline
(-)-Incarvilline		 81.48
C00034747 cis-Linalool oxide pyranoid
Z-Pyranoid linalool oxide		 81.48
C00035674 Lavandulyl acetate
(-)-Lavandulyl acetate		 81.48
C00036263 2-Tridecanone 81.48
C00046163 MKN-004C
(+)-MKN-004C		 81.48
C00048140 Speciosin H
(-)-Speciosin H		 81.48
C00048141 Speciosin I
(+)-Speciosin I		 81.48
C00048142 Speciosin J
(+)-Speciosin J		 81.48
C00048560 Tridecanal 81.48
C00049147 Dictamnol
(+)-Dictamnol		 81.48
C00050289 Kinabalurine A
(+)-Kinabalurine A		 81.48
C00050290 Kinabalurine B
(-)-Kinabalurine B		 81.48
C00050292 Kinabalurine D
(-)-Kinabalurine D		 81.48
C00050293 Kinabalurine E
(+)-Kinabalurine E		 81.48
C00050294 Kinabalurine F
(+)-Kinabalurine F		 81.48
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