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


and

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




INPUT WORD = C00010399 , 50% or more
[ Metabolite Name : 6-Chloromethyl-3,8-dimethoxy-2-methyl-1,6-octadiene ]
Number of matched data : 75

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010400 6-Chloromethyl-1,8-dimethoxy-2-methyl-2,6-octadiene 93.10
C00022685 6-Hydroxy-7(9)-dehydro-6,7-dihydrogeranyl acetate 89.66
C00022687 6-Oxo-7(9)-dehydro-6,7-dihydrogeranyl acetate 89.66
C00010397 (Z)-(-)-8-Chloro-6-chloromethyl-3-methoxy-2-methyl-1,6--octadiene 86.21
C00042866 Propanoic acid 2-methyl-3-hydroxy-2,4,4-trimethylpentyl ester 86.21
C00021225 [1aR-(1aalpha,4alpha,7alpha,7abeta,7balpha)]-1a,2,3,4,6,7,7a,7b-Octahydro-1,1,4,7-tetramethyl-1H-cycloprop[e]azulene 84.38
C00036763 Aromadendra-1,9-diene 84.38
C00020384 6,9-Guaiadiene 83.87
C00022686 6-Peroxy-7(9)-dehydro-6,7-dihydrogeranyl acetate 83.87
C00037222 Guaiane 83.87
C00007453 beta-Elemene
Cyclohexane		 83.33
C00029272 (-)-(S)-Haliclorensin 83.33
C00035434 (-)-cis-beta-Elemene 83.33
C00036271 (-)-beta-Elemene 83.33
C00000842 Bornyl acetate 82.76
C00001265 n-Pentadecane
Pentadecane		 82.76
C00001292 Safynol 82.76
C00010295 3,7-Dimethyl-2,5-octadiene-1,7-diol 82.76
C00010396 (Z)-(-)-8-Chloro-6-chloromethyl-2-methyl-1,6-octadien-3-ol 82.76
C00010432 Chondrocole A 82.76
C00013221 Cybullol
2,[2S-(2alpha,4aalpha,5alpha,8abeta)]-Octahydro-5,8a-dimethyl-4a(2H)-naphthalenediol		 82.76
C00022689 6-Hydroxy-7(9)-dehydro-6,7-dihydroneryl acetate 82.76
C00030882 2-Octyl 3-methyl butyrate
Octyl isovalerate		 82.76
C00035692 Methyl laurate
Lauric acid, methyl ester		 82.76
C00043506 Fomannoxin 82.76
C00044936 Modiolin 82.76
C00021332 Naviculol 81.82
C00000219 Methyl jasmonate 81.25
C00000223 Methyl epijasmonate
Methyl-7-iso-jasmonate		 81.25
C00000226 (+)-9,10-Dihydro-7-iso-jasmonic acid 81.25
C00001286 Ichthyotherol 81.25
C00017559 KS 504e 81.25
C00020166 Calacone 81.25
C00021220 Viridiflorene
Ledene
Ledene Oxide		 81.25
C00021226 4-Aromadendrene 81.25
C00021227 alpha-Gurjunene 81.25
C00021228 9-Aromadendrene 81.25
C00021229 L-Alloaromadendrene
Alloaromadendrene
allo-Aromadendrene		 81.25
C00021230 (+)-Aromadendrene
Aromadendrene
(+)-Aromadendr-7(15)-ene		 81.25
C00021757 Khusimone 81.25
C00021758 Tricyclovetivene
Zizaene
Khusimene		 81.25
C00021884 beta-Bourbonene
(E)-beta-Bourbonene		 81.25
C00021885 Norbourbonone 81.25
C00035800 allo-Aromadendr-9-ene
9-Alloaromadendrene		 81.25
C00036399 11-Bourbonene 81.25
C00038071 (+)-alpha-Gurjunene 81.25
C00049150 epi-Swartzianin A
(-)-epi-Swartzianin A		 81.25
C00050151 Madolin C 81.25
C00003186 beta-Eudesmene
beta-Selinene		 80.65
C00007635 CID is old! 80.65
C00011500 trans-(+-)-2-Methyl-5-(2-methyl-5-isopropenyltetrahydro-2-furyl)furan 80.65
C00011501 trans-(+-)-2-Methyl-5-(2-methyl-5-isopropyltetrahydro-2-furyl)furan 80.65
C00011502 cis-(+-)-2,3,4,5-Tetrahydro-2,5'-dimethyl-5-(1-methylethenyl)-2,2'-bifuran 80.65
C00011503 cis-(+-)-2-Methyl-5-(2-methyl-5-isopropyltetrahydro-2-furyl)furan 80.65
C00011971 Bicycloelemene
(-)-Bicycloelemene
3-Ethenyl-3,7,7-trimethyl-2-(1-methylethenyl)bicyclo[4.1.0]heptane		 80.65
C00012425 (+)-Bicyclogermacrene
Bicyclogermacren
Bicyclogermacrene
Biclyclogermacrene		 80.65
C00020042 gamma-Bulgarene 80.65
C00020044 (-)-epsilon-Bulgarene 80.65
C00020052 gamma1-Cadinene 80.65
C00020130 gamma-Muurolene
1beta-Cadina-4,10(15)-diene		 80.65
C00020375 Guaia-1(5),6-diene
(1S-trans)-1,2,3,4,5,6-Hexahydro-1,4-dimethyl-7-(1-methylethyl)azulene		 80.65
C00020377 alpha-Guaiene
Guaia-1(5),11-diene		 80.65
C00020379 alpha-Bulnesene
delta-Guaiene		 80.65
C00020380 Sclerosporene 80.65
C00020383 (+)-gamma-Gurjunene
gamma-Gurjunene		 80.65
C00022688 6-Peroxy-7(9)-dehydro-2,3,6,7-tetrahydrogeranyl acetate 80.65
C00022691 9-Peroxy-5,6E-dehydro-6,7-dihydrogeranyl acetate 80.65
C00029559 (+)-5-epi-Aristolochene
5-epi-Aristolochene
(+)-Epiaristolochene		 80.65
C00030434 Guaia-6,9-diene
(+)-Guaia-6,9-diene		 80.65
C00034461 Cadina-1(6),4-diene 80.65
C00036276 (-)-Eudesma-2,4(15)-11-triene 80.65
C00038052 (-)-cis-Cadina-1(6),4-diene 80.65
C00040347 Spilanthol 80.65
C00040349 Spirolepechinene
(-)-Spirolepechinene		 80.65
C00045566 4,10-Dimethyldodecanoic acid 80.65
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