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


and

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




INPUT WORD = C00021603 , 50% or more
[ Metabolite Name : Laurencenone A ]
Number of matched data : 57

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00021613 2-Chloro-3-hydroxy-7-chamigren-9-one 97.30
C00021602 Laurencenone D 94.59
C00021627 3-Bromo-4-chloro-7(14)-chamigren-9-ol 94.59
C00021600 Glanduliferol 91.89
C00021626 Isoobtusol 89.74
C00021612 4-Chloro-3,7-epoxy-9-chamigranone 89.47
C00021996 Rhodolaureol 89.47
C00012834 [2R-(2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-alpha-methylene-6-oxo-2-naphthaleneacetic acid 89.19
C00012841 alpha-Rotunol
[4aS-(4aalpha,6beta,8abeta)]-4a,5,6,7,8,8a-hexahydro-4a-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone		 89.19
C00012842 (+)-beta-Rotunol
beta-Rotunol
[4aR-(4aalpha,6alpha,8aalpha)]-4a,5,6,7,8,8a-hexahydro-4a-hydroxy-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone		 89.19
C00012855 Isopterocarpolone
[4aR-(4aalpha,6beta,8abeta)]-4a,5,6,7,8,8a-Hexahydro-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-2(1H)-naphthalenone		 89.19
C00021616 2,10-Dibromo-7-chamigren-3-ol 89.19
C00038316 7alpha-Hydroxyisopterocarpolone 89.19
C00040944 Dictyophorin A 89.19
C00043342 Canusesnol C
(+)-Canusesnol C		 87.18
C00012912 Pinnatifidin (Helenium)
[3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-3,3a,4,4a,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenepinnatifidin
Naphtho[2,3-b]furan-2,7-dione		 86.84
C00021636 Laurencial 86.84
C00003191 Solavetivone 86.49
C00011916 Puertitol B 86.49
C00011920 Theonellin formamide 86.49
C00012698 [4aR-(4aalpha,5alpha,6beta,8abeta)]-4a,5,6,7,8,8a-Hexahydro-5-hydroxy-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-2(1H)-naphthalenone 86.49
C00012756 [4aR-(4aalpha,6beta,8aalpha)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 86.49
C00012757 [4aS-(4aalpha,6alpha,8abeta)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 86.49
C00012758 [4aS-(4aalpha,6alpha,8aalpha)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone 86.49
C00012777 alpha-Chenopodiol
[1R-(1alpha,2beta,4abeta,8aalpha)]-1,2,3,4,4a,5,6,8a-octahydro-1-hydroxy-alpha,alpha,4a,8-tetramethyl-2-naphthalenemethanol		 86.49
C00012833 2-Hydroxyisocostic acid 86.49
C00012843 Chenopodienolone
(6R-cis)-6,7,8,8a-Tetrahydro-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-2(1H)-naphthalenone		 86.49
C00012879 (+)-Isoalloalantolactone
Isoalloalantolactone
[3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-3a,4,4a,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 86.49
C00012880 Diplophyllolide A
[3aS-(3aalpha,4aalpha,8abeta,9aalpha)]-3a,4,4a,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 86.49
C00017017 4-Hydroxy-2-oxovalencene
[4S-(4alpha,4abeta,6alpha)]-4,4a,5,6,7,8-Hexahydro-4-hydroxy-4,4a-dimethyl-6-(1-methylethyl)-2(3H)-naphthalenone		 86.49
C00021597 Nidifidienol 86.49
C00021601 Hurgadol 86.49
C00021609 10-Bromo-2,3-epoxy-7-chamigrene 86.49
C00021620 2,10-Dibromo-3-chloro-alpha-chamigrene
4,10-Dibromo-3-chloro-alpha-chamigrene
(-)-4,10-Dibromo-3-chloro-alpha-chamigrene		 86.49
C00021623 Obtusane 86.49
C00021870 Mustakone 86.49
C00035842 iso-Acorone 86.49
C00040945 Dictyophorin B 86.49
C00042987 Scortechterpene B
(+)-Scortechterpene B		 86.49
C00046525 Xenitorin B
(-)-Xenitorin B		 86.49
C00046528 Xenitorin E
(-)-Xenitorin E		 86.49
C00046529 Xenitorin F
(-)-Xenitorin F		 86.49
C00047844 Deoxyuvidin B 86.49
C00011693 [1S-[1alpha(3S*,6R*),3beta,4alpha]]-3-Bromo-6-(4-bromo-3-chloro-4-methylcyclohexyl)tetrahydro-2,2,6-trimethyl-2H-pyran 84.62
C00012735 [1S-(1alpha,2beta,4abeta,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-2-(1-methylethenyl)-1-naphthalenol acetate 84.62
C00021624 2,10-Dibromo-3-chlorochamigren-7-en-9-ol 84.62
C00040857 9-Hydroxy-4,10-dibromo-3-chloro-alpha-chamigrene 84.62
C00000134 Abscisic acid
(s)-(+)-Abscisic acid
2,4-Pentadienoic acid
cis-abscisic acid		 84.21
C00003363 Santamarin
Santamarine
Balchanin		 84.21
C00013037 11beta,13-Dihydrosantamarin
11,13-Dihydrosantamarine
Dihydrosantamarin		 84.21
C00013223 Douglanin
Douglanine
[3aS-(3aalpha,5abeta,6alpha,9aalpha,9bbeta)]-3a,4,5,5a,6,7,9a,9b-Octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 84.21
C00021318 Longipin-2-ene-7beta,9alpha-diol-1-one 84.21
C00021319 10,12-Dihydroxy-3-longipinen-5-one 84.21
C00021604 Nidifocene 84.21
C00033210 Montiporyne F 84.21
C00034364 11alpha,13-Dihydrosantamarin 84.21
C00044860 Lemnal-1(10)-ene-2,12-dione
(-)-Lemnal-1(10)-ene-2,12-dione		 84.21
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