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


and

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




INPUT WORD = C00023229 , 50% or more
[ Metabolite Name : Demethoxyencecalin ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00002395 Dehydrotremetone 96.77
C00029692 Anofinic acid
1-Hydroxy-3',3'-dimethylchromene		 96.77
C00002427 Eupatoriochromene
Desmethylencecalin		 93.94
C00001282 Eutypine 93.55
C00002412 Tremetone 93.55
C00023266 2,2-Dimethyl-6-vinylchroman-4-one 93.55
C00023271 2,2-Dimethyl-6-(1-hydroxyethyl)chroman-4-one 90.91
C00023272 4-Methoxy-6-vinyl-2,3-dimethylchromene 90.91
C00030228 Euparin 90.91
C00045270 Colpuchol 90.91
C00002439 7-Methoxy-2,2-dimethylchromene
Precocene 1		 90.32
C00042065 2,2-Dimethyl-6-methoxy-4-chromanone 90.32
C00002426 Encecalin 88.57
C00023228 Encecalinol
6-(1-Hydroxyethyl)-7-methoxy-2,2-dimethylchromene		 88.57
C00032696 Acetovanillochromene 88.57
C00002399 6-Hydroxytremetone 87.88
C00002440 Ageratochromene
Precocene 2		 87.88
C00033026 Hydroxytremetone
(-)-Hydroxytremetone		 87.88
C00039752 Methyl 2,2-dimethyl-2H-1-chromene-6-carboxylate 87.88
C00045684 Bitalin A 87.88
C00022703 2-Isovaleroyl-4-[1-hydroxyethyl]-phenol 87.50
C00022704 4-Hydroxy-3-isovalerylacetophenone 87.50
C00023264 4-Methoxy-3-(isopenten-2-yl)acetophenone 87.50
C00002699 4'-Hydroxy-3'-phenylacetophenone 87.10
C00002402 6-O-Methyleuparin 85.71
C00002410 Toxol 84.85
C00029553 5,6-Dimethoxy-2-isopropenylbenzofuran
5,6-Dimethoxy-2-(1-methylethenyl)-1-benzofuran		 84.85
C00035618 Euparone 84.85
C00023270 1-[2-Hydroxy-5-(1-hydroxyethyl)phenyl]-3-methyl-2-buten-1-one 84.38
C00016577 (+)-Sattabacin
Sattabacin		 83.87
C00020026 Setarin 83.87
C00020112 Cadalene
Cadalin
1,6-Dimethyl-4-isopropylnaphthalene		 83.87
C00030982 Phellodenol A 83.87
C00036621 6-Hydroxy-2,2-dimethylchroman-4-one 83.87
C00040614 Valencic acid 83.87
C00043506 Fomannoxin 83.87
C00044076 Anisoxide 83.87
C00021110 2-Hydroxy-1-(7-methoxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-ethanone 83.78
C00049795 Isoevodionol 83.78
C00034429 6-Methoxytremetone 82.86
C00036347 (3S,4R)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane
(+)-(3S,4R)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane		 82.86
C00036348 (3S,4S)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane
(-)-(3S,4S)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane		 82.86
C00049305 Sporovexin A
(-)-Sporovexin A		 82.35
C00016320 (E)-1-[3-(Chloromethylene)-2,3-dihydro-1-benzoxepin-7-yl]-ethanone
Pterulone
Pterulone A		 81.82
C00020198 Tetradehydrochromoarnottione 81.82
C00029450 2-Acetyl-5,6-dimethoxybenzofuran
Caleprunin B
Eupatarone		 81.82
C00045474 (+)-Cyclosordariolone 81.82
C00016097 YUA 001 81.25
C00034602 Methyl-4-(butyryloxy)benzoate 81.25
C00039184 Evofolin C 81.25
C00042069 2,6-bis(1,1-Dimethylethyl)-4-methylphenol
2,6-Di-tert-butyl-4-methylphenol		 81.25
C00042565 Gossonorol 81.25
C00045866 Doryanine 81.25
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