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


and

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




INPUT WORD = C00002410 , 50% or more
[ Metabolite Name : Toxol ]
Number of matched data : 54

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00022703 2-Isovaleroyl-4-[1-hydroxyethyl]-phenol 96.97
C00022704 4-Hydroxy-3-isovalerylacetophenone 96.97
C00002399 6-Hydroxytremetone 93.94
C00023270 1-[2-Hydroxy-5-(1-hydroxyethyl)phenyl]-3-methyl-2-buten-1-one 93.94
C00023271 2,2-Dimethyl-6-(1-hydroxyethyl)chroman-4-one 93.94
C00033026 Hydroxytremetone
(-)-Hydroxytremetone		 93.94
C00036310 (+)-Gynunone 91.67
C00036347 (3S,4R)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane
(+)-(3S,4R)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane		 91.43
C00036348 (3S,4S)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane
(-)-(3S,4S)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane		 91.43
C00002412 Tremetone 90.91
C00030228 Euparin 90.91
C00045684 Bitalin A 90.91
C00034429 6-Methoxytremetone 88.57
C00002395 Dehydrotremetone 87.88
C00002427 Eupatoriochromene
Desmethylencecalin		 87.88
C00002699 4'-Hydroxy-3'-phenylacetophenone 87.88
C00023266 2,2-Dimethyl-6-vinylchroman-4-one 87.88
C00043506 Fomannoxin 87.88
C00002402 6-O-Methyleuparin 85.71
C00021111 2-[4-Methyl-2-(2-methylpropoxy)phenyl]-oxiranemethanol 85.71
C00011901 ar-Pseudotsugonal
(R)-4-(1,5-Dimethyl-3-oxohexyl)-benzaldehyde		 85.29
C00034938 Curvulin 85.29
C00040826 4-(3-Methyl-2-butenoxy)isonitrosoacetophenone 85.29
C00047336 Polygonophenone 85.29
C00049305 Sporovexin A
(-)-Sporovexin A		 85.29
C00001831 Carnegine 84.85
C00002990 Flossonol 84.85
C00003004 6-Methoxymellein 84.85
C00011625 (+)-ar-Turmerone
(S)-ar-Turmerone
ar-Tumerone		 84.85
C00011641 Turmerone
(S)-2-Methyl-6-(4-methyl-1,4-cyclohexadien-1-yl)-2-hepten-4-one		 84.85
C00012516 (+)-beta-Cuparenone
beta-Cuparenone
beta-Cuparenone		 84.85
C00015215 Sterin B 84.85
C00016097 YUA 001 84.85
C00016320 (E)-1-[3-(Chloromethylene)-2,3-dihydro-1-benzoxepin-7-yl]-ethanone
Pterulone
Pterulone A		 84.85
C00016577 (+)-Sattabacin
Sattabacin		 84.85
C00020254 Jungianol 84.85
C00023229 Demethoxyencecalin 84.85
C00023267 2-Senecioyl-4-vinylphenol 84.85
C00024216 Mysorenone B 84.85
C00029553 5,6-Dimethoxy-2-isopropenylbenzofuran
5,6-Dimethoxy-2-(1-methylethenyl)-1-benzofuran		 84.85
C00029831 Bisacumol
(+)-Bisacumol		 84.85
C00034602 Methyl-4-(butyryloxy)benzoate 84.85
C00035053 ar-Turmerol 84.85
C00035618 Euparone 84.85
C00037571 Ochratoxin beta 84.85
C00040485 threo-3-Chloro-1-(4-hydroxy-3-methoxyphenyl)propane-1,2-diol
(-)-threo-3-Chloro-1-(4-hydroxy-3-methoxyphenyl)propane-1,2-diol		 84.85
C00042065 2,2-Dimethyl-6-methoxy-4-chromanone 84.85
C00047149 4-(4'-Hydroxy-3'-methylbutoxy)benzaldehyde 84.85
C00046122 Mansonone P
(-)-Mansonone P		 83.78
C00000293 Grandinol 83.33
C00024217 Mysorenone C 83.33
C00035467 1-Acetyl-N-salicyloyl-2-aminopropan-3-ol 83.33
C00045507 10-Oxodehydrodihydrobotrydial
(+)-10-Oxodehydrodihydrobotrydial		 83.33
C00049306 Sporovexin B
(-)-Sporovexin B		 83.33
Page Top