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


and

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




INPUT WORD = C00045684 , 50% or more
[ Metabolite Name : Bitalin A ]
Number of matched data : 57

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00002399 6-Hydroxytremetone 96.97
C00033026 Hydroxytremetone
(-)-Hydroxytremetone		 96.97
C00002412 Tremetone 93.94
C00023271 2,2-Dimethyl-6-(1-hydroxyethyl)chroman-4-one 93.94
C00030228 Euparin 93.94
C00034429 6-Methoxytremetone 91.43
C00002395 Dehydrotremetone 90.91
C00002410 Toxol 90.91
C00002427 Eupatoriochromene
Desmethylencecalin		 90.91
C00022703 2-Isovaleroyl-4-[1-hydroxyethyl]-phenol 90.91
C00022704 4-Hydroxy-3-isovalerylacetophenone 90.91
C00036310 (+)-Gynunone 88.89
C00002402 6-O-Methyleuparin 88.57
C00016097 YUA 001 87.88
C00023229 Demethoxyencecalin 87.88
C00023264 4-Methoxy-3-(isopenten-2-yl)acetophenone 87.88
C00023266 2,2-Dimethyl-6-vinylchroman-4-one 87.88
C00023270 1-[2-Hydroxy-5-(1-hydroxyethyl)phenyl]-3-methyl-2-buten-1-one 87.88
C00034602 Methyl-4-(butyryloxy)benzoate 87.88
C00035618 Euparone 87.88
C00039184 Evofolin C 87.88
C00040014 Pichiacin A 87.88
C00047149 4-(4'-Hydroxy-3'-methylbutoxy)benzaldehyde 87.88
C00002426 Encecalin 85.71
C00023228 Encecalinol
6-(1-Hydroxyethyl)-7-methoxy-2,2-dimethylchromene		 85.71
C00032696 Acetovanillochromene 85.71
C00036347 (3S,4R)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane
(+)-(3S,4R)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane		 85.71
C00036348 (3S,4S)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane
(-)-(3S,4S)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane		 85.71
C00039754 Methyl anodendroate 85.71
C00002711 1'-Acetoxychavicol acetate 85.29
C00031421 trans-p-Coumaryl diacetate 85.29
C00031531 1'S-1'-Acetoxychavicol acetate
1'-Acetoxychavicol acetate
Galangal acetate		 85.29
C00040826 4-(3-Methyl-2-butenoxy)isonitrosoacetophenone 85.29
C00043717 Methyl taboganate 85.29
C00047163 Ailanthoidiol 85.29
C00049305 Sporovexin A
(-)-Sporovexin A		 85.29
C00001282 Eutypine 84.85
C00002440 Precocene 2 84.85
C00002699 4'-Hydroxy-3'-phenylacetophenone 84.85
C00002990 Flossonol 84.85
C00011623 (+-)-(E)-Nuciferol
(+-)-Nuciferol		 84.85
C00011624 (+)-Nuciferal
(E)-Nuciferal
(E,S)-(+)-Nuciferal		 84.85
C00011626 2-Methyl-6-(4-methylphenyl)-1-hepten-3-one
1,3,5,11-Bisabolatetraen-10-one		 84.85
C00011627 1,3,5-Bisabolatrien-10-one
2-Methyl-6-(4-methylphenyl)-3-heptanone		 84.85
C00011927 3,7-Bis(hydroxymethyl)-1-benzoxepin-5(2H)-one 84.85
C00023272 4-Methoxy-6-vinyl-2,3-dimethylchromene 84.85
C00029450 2-Acetyl-5,6-dimethoxybenzofuran
Caleprunin B
Eupatarone		 84.85
C00029553 5,6-Dimethoxy-2-isopropenylbenzofuran
5,6-Dimethoxy-2-(1-methylethenyl)-1-benzofuran		 84.85
C00029692 Anofinic acid
1-Hydroxy-3',3'-dimethylchromene		 84.85
C00030514 Integrifoliolin 84.85
C00030791 Monaspyranoindole 84.85
C00036457 2,4,5-Trimethoxycinnamaldehyde 84.85
C00037571 Ochratoxin beta 84.85
C00039752 Methyl 2,2-dimethyl-2H-1-chromene-6-carboxylate 84.85
C00042065 2,2-Dimethyl-6-methoxy-4-chromanone 84.85
C00043506 Fomannoxin 84.85
C00045270 Colpuchol 84.85
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