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


and

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




INPUT WORD = C00003149 , 50% or more
[ Metabolite Name : Hydroxyisopatchoulenone ]
Number of matched data : 91

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00020415 1-Hydroxy-4,11-guaiadien-3-one 94.29
C00049304 Sootepdienone
(+)-Sootepdienone		 94.29
C00050285 Hydroxycolorenone 94.29
C00021288 Scariodione 91.67
C00020398 1beta,10betaH-Guaia-4,11-dien-3-one 91.43
C00020417 11-Hydroxy-4-guaien-3-one 91.43
C00021240 ent-Cyclocolorenone
(+)-Cyclocolorenone		 91.43
C00022791 1alpha,7alpha,10alphaH-Guaia-4,11(13)-dien-3-one 91.43
C00030184 CID is old! 91.43
C00050295 Methoxycolorenone
(+)-Methoxycolorenone		 89.19
C00012530 Rosulantol 88.57
C00020107 Schisandronol 88.57
C00020117 Mansonone A
5,6,7,8-Tetrahydro-5-isopropyl-3,8-dimethyl-1,2-naphthoquinone		 88.57
C00020138 10-Hydroxy-4-muurolen-3-one 88.57
C00020177 3-Hydroxy-8-calamenenone
(1S,4R)-7-Hydroxycalamenen-3-one		 88.57
C00020226 9-Oxoageraphorone 88.57
C00020227 9beta-Hydroxyageraphorone 88.57
C00021249 Dihydromylione A 88.57
C00047658 2-Keto-5-hydroxyguai-3,11-diene
(+)-2-Keto-5-hydroxyguai-3,11-diene		 88.57
C00049060 1,2-Dehydro-3-oxo-beta-gurjunene
(+)-1,2-Dehydro-3-oxo-beta-gurjunene		 88.57
C00021276 Anhydroivaxillarin 87.18
C00020951 3-Oxo-4-guaien-12,8beta-olide 86.84
C00012700 (+)-6alpha-Carissanol
6alpha-Carissanol
[4aS-(4aalpha,7alpha,8beta)]-4,4a,5,6,7,8-Hexahydro-8-hydroxy-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-2(3H)-naphthalenone		 86.49
C00012701 (+)-6beta-Carissanol
[4aS-(4aalpha,7alpha,8alpha)]-4,4a,5,6,7,8-Hexahydro-8-hydroxy-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-2(3H)-naphthalenone		 86.49
C00020708 Grilactone 86.11
C00020714 Isodehydrocostus lactone 86.11
C00021021 11beta,13-Dihydro-desoxo-achalensolide 86.11
C00021261 Plagiochilide 86.11
C00037033 Deoxyarteannuin B
Deoxyisoartemisinin C		 86.11
C00037054 Dihydrodeoxyarteannuin B 86.11
C00040944 Dictyophorin A 86.11
C00042884 Pulicanadienol
(+)-Pulicanadienol		 86.11
C00045352 Mokko lactone 86.11
C00000477 (3Z,12Z)-Laurediol 85.71
C00000479 (3Z)-12,13-Dihydrolaurediol 85.71
C00003163 Lubimin 85.71
C00011538 Isomyomontanone 85.71
C00011545 (E)-(+)-2-[2-(2,2-Dimethyl-6-methylenecyclohexyl)ethyl]-2-butenedial 85.71
C00011547 Anhydrotrisporone 85.71
C00011601 (E)-5-(1,5-Dimethyl-3-oxo-1-hexenyl)-2-methyl-2-cyclohexen-1-one 85.71
C00011648 5-[3-(3,3-Dimethyloxiranyl)-1-methylenepropyl]-2-methyl-2-cyclohexen-1-one 85.71
C00011675 [4R-[4alpha,6alpha(S*)]]-6-(1,5-Dimethyl-4-hexenyl)-4-hydroxy-3-methyl-2-cyclohexen-1-one 85.71
C00011697 Angrendiol 85.71
C00011731 Curdione
(+)-Curdione
(+)-Germacr-1(10)-ene-5,8-dione		 85.71
C00012006 Saussurea lactone
(all-S)-Hexahydro-7-isopropenyl-3,6-dimethyl-6-vinyl-2(3H)-benzofuranone		 85.71
C00012759 (+)-alpha-Cyperone
Eudesma-4,11-dien-3-one
(4aS-cis)-4,4a,5,6,7,8-Hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-2(3H)-naphthalenone		 85.71
C00012760 (+)-12-Hydroxy-alpha-cyperone
(4aS-cis)-4,4a,5,6,7,8-Hexahydro-7-[1-(hydroxymethyl)ethenyl]-1,4a-dimethyl-2(3H)-naphthalenone		 85.71
C00012761 1,2-Dehydro-alpha-cyperone
(+)-Eudesma-1,4,11-trien-3-one
(4aS-cis)-5,6,7,8-Tetrahydro-1,4a-dimethyl-7-(1-methylethenyl)-2(4aH)-naphthalenone		 85.71
C00012778 Voleneol
Eudesm-4(15)-ene-1beta,6alpha-diol
1beta,6alpha-Dihydroxyeudesm-4(15)-ene
[1S-(1alpha,2beta,4abeta,5beta,8aalpha)]-Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1,5-naphthalenediol		 85.71
C00012780 Platambin
[1S-(1alpha,2beta,4aalpha,5alpha,8abeta)]-Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1,5-naphthalenediol		 85.71
C00012801 alpha-Verbesinol
[1R-(1alph,2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-2-(1-methylethyl)-1-naphthalenol		 85.71
C00012802 Isoacolamone
[2S-(2alpha,4aalpha,8abeta)]-3,4,4a,5,6,8a-Hexahydro-4a,8-dimethyl-2-(1-methylethyl)-1(2H)-naphthalenone		 85.71
C00012818 (2R-trans)-3,4,4a,5,6,7-Hexahydro-2-hydroxy-4a,8-dimethyl-2-(1-methylethyl)-1(2H)-naphthalenone
7alpha-Hydroxyneoacolamone		 85.71
C00012827 [3R-(3alpha,4abeta,7beta)]-2,3,4,4a,5,6,7,8-Octahydro-3-hydroxy-4a-methyl-7-(1-methylethenyl)-1-naphthalenecarboxaldehyde 85.71
C00017474 Aristolone 85.71
C00020078 (1R-trans)-1,2,3,4-Tetrahydro-7-hydroxy-6-methyl-4-(1-methylethyl)-1-naphthalenemethanol 85.71
C00020109 10-Hydroxy-cadin-4-en-3-one 85.71
C00020134 gamma-Muurolen-15-oic acid 85.71
C00020137 (-)-1beta,10betaH-Cadin-4-ene-3alpha,10-diol 85.71
C00020139 1beta,10betaH-Cadin-4-ene-3beta,10-diol 85.71
C00020174 (1S,3R,4S)-Calamenene-3,7-diol 85.71
C00020210 6-Hydroxyprimnatrienone 85.71
C00020224 9-Oxo-10,11-dehydroageraphorone 85.71
C00020373 Furopelargone D 85.71
C00020401 Watsonol A 85.71
C00020407 Karatavin 85.71
C00020766 8-Oxo-9,12-dehydroverboccidentene 85.71
C00021253 Plagiochilal A
Hanegokedial		 85.71
C00021284 Cyperotundone
Isopatchoulenone		 85.71
C00021323 Marsupellone 85.71
C00021585 Acoronene 85.71
C00021705 Germacrene-D-lactone 85.71
C00029437 2,7-dihydroxy-11,12-dehydrocalamenene
(-)-2,7-dihydroxy-11,12-dehydrocalamenene		 85.71
C00029926 Chabrolidione A 85.71
C00030809 Neocurdione 85.71
C00032260 Sugikurojinol A
(4S)-2,6,10-Bisaboratrien-4-ol-1-one		 85.71
C00033140 Madolin E
(+)-Madolin E		 85.71
C00033700 Carissone
(+)-Carissone		 85.71
C00034980 (-)-7-Hydroxycalamenene 85.71
C00035842 iso-Acorone 85.71
C00038047 (-)-7-epi-Isojunenol 85.71
C00038751 Chlorantene G
(+)-Chlorantene G		 85.71
C00039901 Oleodaphnal
(+)-Oleodaphnal		 85.71
C00039902 Oleodaphnone
(+)-Oleodaphnone		 85.71
C00040945 Dictyophorin B 85.71
C00043348 Canusesnol I
(+)-Canusesnol I		 85.71
C00043675 Lubiminol
(+)-Lubiminol		 85.71
C00043973 Teucladiol 85.71
C00045807 Cubebenone
(+)-Cubebenone		 85.71
C00046528 Xenitorin E
(-)-Xenitorin E		 85.71
C00046529 Xenitorin F
(-)-Xenitorin F		 85.71
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