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


and

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




INPUT WORD = C00020079 , 50% or more
[ Metabolite Name : 3-Hydroxy-14-calamenoic acid ]
Number of matched data : 67

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00020080 3-Methoxy-14-calamenoic acid 94.87
C00020078 (1R-trans)-1,2,3,4-Tetrahydro-7-hydroxy-6-methyl-4-(1-methylethyl)-1-naphthalenemethanol 94.59
C00012524 Deoxyhelicobasidin 91.89
C00020180 (1S,3R,4R)-Calamenene-3,4,7-triol 91.89
C00020185 (1S,4S)-7-Methoxycalamenen-3-one 91.89
C00020427 Pechueloic acid 91.89
C00020773 (1S,4R)-7-Methoxycalamenen-4-ol 91.89
C00020774 (1S,3R,4S)-Calamenene-3,4,7-triol 91.89
C00029437 2,7-dihydroxy-11,12-dehydrocalamenene
(-)-2,7-dihydroxy-11,12-dehydrocalamenene		 91.89
C00037241 Heliannuol D
(+)-Heliannuol D		 91.89
C00040054 Populene E
(+)-Populene E		 89.74
C00040055 Populene F
(+)-Populene F		 89.74
C00020097 Heritol 89.47
C00045887 Enokipodin A
(+)-Enokipodin A		 89.47
C00012512 2,3-Dihydroxycuparene
(S)-3-Methyl-6-(1,2,2-trimethylcyclopentyl)-1,2-benzenediol		 89.19
C00012540 [1S-(1alpha,2beta,5alpha)]-2-(1,2-Dimethylbicyclo[3.1.0]hex-2-yl)-5-methyl-2,5-cyclohexadiene-1,4-dione
(-)-Laurequinone
Laurequinone		 89.19
C00020069 3-Hydroxy-beta-calacorene 89.19
C00020075 5-Hydroxy-8-methoxycalamenene 89.19
C00020116 Lacinilene C 89.19
C00020168 3,5-Dihydro-8-hydroxy-5-isopropyl-2,7-dimethyl-1-benzoxepin-4(2H)-one 89.19
C00020174 (1S,3R,4S)-Calamenene-3,7-diol 89.19
C00036014 4'-Methoxycinnamyl isovalerate 89.19
C00037239 Heliannuol A
(-)-Heliannuol A		 89.19
C00037240 Heliannuol C
(-)-Heliannuol C		 89.19
C00037244 Heliannuol G
(-)-Heliannuol G		 89.19
C00045888 Enokipodin B
(-)-Enokipodin B		 89.19
C00049723 Heliannuol K
(+)-Heliannuol K		 89.19
C00037243 Heliannuol F
(+)-Heliannuol F		 87.18
C00037247 Heliannuol L 87.18
C00003364 Santonin
Semenen
(-)-alpha-Santonin
(-)-Santonin
a-Santonin
[3S-(3alpha,3aalpha,5abeta,9bbeta)]-3a,5,5a,9b-Tetrahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 86.84
C00003365 beta-Santonin
[3R-(3alpha,3abeta,5aalpha,9balpha)]-3a,5,5a,9b-Tetrahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 86.84
C00012942 (-)-Yomogin
[3aR-(3aalpha,8abeta,9aalpha)]-3a,8a,9,9a-Tetrahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2,6(3H,4H)-dione		 86.84
C00017502 Cacalolide 86.84
C00020101 Hibiscone D 86.84
C00020951 3-Oxo-4-guaien-12,8beta-olide 86.84
C00021277 3-Oxo-4,11(13)-ivaxallaradien-12-oic acid 86.84
C00022587 Isovalerylferulate 86.84
C00035445 [4]-Isogingerol 86.84
C00037249 Helibisabonol A
(-)-Helibisabonol A		 86.84
C00037250 Helibisabonol B 86.84
C00042801 Ophioceric acid
(+)-Ophioceric acid		 86.84
C00002768 Prenyl cafeate 86.49
C00012511 (-)-delta-Cuparenol
(S)-2-Hydroxycuparene
delta-Cuparenol
Cuparophenol
(S)-2-Methyl-5-(1,2,2-trimethylcyclopentyl)phenol		 86.49
C00012535 Cyclolaurenol
[1S-(1alpha,2beta,5alpha)]-4-Bromo-5-(1,2-dimethylbicyclo[3.1.0]hex-2-yl)-2-methylphenol		 86.49
C00012539 Laurinterol
[1S-(1alpha,2beta,5alpha)]-4-Bromo-2-(1,2-dimethylbicyclo[3.1.0]hex-2-yl)-5-methylphenol		 86.49
C00012545 (-)-Herbertenediol
Herbertenediol(S)-5-Methyl-3-(1,2,2-trimethylcyclopentyl)-1,2-benzenediol		 86.49
C00012546 Herbertenolide
(3aS-trans)-2,3,3a,9b-Tetrahydro-3a,8,9b-trimethylcyclopenta[c][1]benzopyran-4(1H)-one		 86.49
C00012693 Heterophyllol
(4alpha,4aalpha,7alpha)-(+)-4,4a,5,6,7,8-hexahydro-4-hydroxy-7-[1-(hydroxymethyl)ethenyl]-1,4a-dimethyl-2(3H)-naphthalenone		 86.49
C00020068 3-Hydroxy-alpha-calacorene 86.49
C00020073 5-Hydroxycalamenene 86.49
C00020175 3-Methoxy-8-calamenenol
(1S,3R,4R)-7-Methoxycalamenen-3-ol		 86.49
C00020177 3-Hydroxy-8-calamenenone
(1S,4R)-7-Hydroxycalamenen-3-one		 86.49
C00020179 3-Methoxy-8-calamenenone
(1S,4R)-7-Methoxycalamenen-3-one		 86.49
C00020200 3-Methoxy-14-norcalamenene 86.49
C00020428 Parishin B 86.49
C00033470 Versicolactone B 86.49
C00034980 (-)-7-Hydroxycalamenene 86.49
C00035991 (-)-Herbertene-1,12-diol 86.49
C00036366 1,13-Dihydroxyherbertene 86.49
C00037245 Heliannuol H
(-)-Heliannuol H		 86.49
C00039901 Oleodaphnal
(+)-Oleodaphnal		 86.49
C00042133 3-O-Acetylniduloic acid 86.49
C00042434 Cyclolauren-2-ol
(+)-Cyclolauren-2-ol		 86.49
C00042682 Laur-11-en-2,10-diol 86.49
C00043340 Canusesnol A
(-)-Canusesnol A		 86.49
C00046403 Sesquichamaenol 86.49
C00049253 Parahigginol D
(-)-Parahigginol D		 86.49
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