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


and

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




INPUT WORD = C00031531 , 50% or more
[ Metabolite Name : 1'S-1'-Acetoxychavicol acetate , 1'-Acetoxychavicol acetate , Galangal acetate ]
Number of matched data : 82

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00002711 1'-Acetoxychavicol acetate 100.00
C00031421 trans-p-Coumaryl diacetate 97.06
C00002712 1'-Acetoxyeugenol acetate 89.47
C00015013 Bhimanone 88.57
C00037498 Methyl piperate 88.57
C00034602 Methyl-4-(butyryloxy)benzoate 88.24
C00036514 3,4-Methylenedioxycinnamylideneacetone 88.24
C00038323 7-O-Ethylguaiacylglycerol
(-)-7-O-Ethylguaiacylglycerol		 88.24
C00040817 3-Ethoxy-1-(4-hydroxy-3-methoxyphenyl)-1-propanone 88.24
C00044787 Goniothalamin epoxide
(+)-Goniothalamin oxide		 88.24
C00046569 1-O-trans-p-Coumaroylglycerol 88.24
C00047336 Polygonophenone 88.24
C00050395 Plumbolactone B 88.24
C00036310 (+)-Gynunone 86.11
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
C00037207 Goniodiol
(+)-Goniodiol		 85.71
C00016128 (-)-Cytoxazone
Cytoxazone		 85.29
C00018069 2-Hexyl-5-propylresorcinol
Antibiotic DB 2073		 85.29
C00033026 Hydroxytremetone
(-)-Hydroxytremetone		 85.29
C00034938 Curvulin 85.29
C00039184 Evofolin C 85.29
C00040826 4-(3-Methyl-2-butenoxy)isonitrosoacetophenone 85.29
C00045684 Bitalin A 85.29
C00047163 Ailanthoidiol 85.29
C00031732 Descurainolide A
(+)-Descurainolide A		 83.78
C00002768 Prenyl cafeate 83.33
C00017449 Norsecoglutinosone 83.33
C00030084 Dactylose A 83.33
C00030085 Dactylose B 83.33
C00031383 Sinapic acid ethyl ester 83.33
C00036200 Plicatin B 83.33
C00036294 (+)-2-Epialtholactone 83.33
C00036309 (+)-Goniotharvensin 83.33
C00036498 2-Methoxy-4-oxo-6-phenyl-hexa-2,5-dienoic acid methyl ester 83.33
C00042560 Globosumone A 83.33
C00050111 Granulosin 83.33
C00016102 7-Acetyl-3,6-dihydroxy-8-methyl-alpha-tetralone
7-Acetyl-3,6-dihydroxy-8-methyl-1-tetralone
GTRI 02		 82.86
C00022705 7-Isopentenyloxycoumarin 82.86
C00034429 6-Methoxytremetone 82.86
C00045588 7-Hydroxy-3-(2,3-dihydroxybutyl)-1(3H)-isobenzofuranone 82.86
C00000743 o-Succinylbenzoic acid
OSB		 82.35
C00002399 6-Hydroxytremetone 82.35
C00002410 Toxol 82.35
C00002691 Aspidinol 82.35
C00002714 Apiol
Parsley apiole
Apiole		 82.35
C00002737 Dillapiol
Dillapiole
Dill apiole		 82.35
C00002758 p-Methoxycinnamic acid ethyl ester 82.35
C00002776 Sinapic acid 82.35
C00002779 Sphagnum acid 82.35
C00002990 Flossonol 82.35
C00003012 Polygonolide 82.35
C00012552 (-)-Debromoaplysin
Debromoaplysin
[3S-(3alpha,3abeta,8bbeta)]-2,3,3alpha,8beta-tetrahydro-3,3alpha,6,8beta-tetramethyl-1H-cyclopenta[b]benzofuran		 82.35
C00014954 NP 25301 82.35
C00016285 (+)-3-Hydroxy-5-(p-hydroxyphenyl)pentanoic acid
Niduloic acid		 82.35
C00016386 Methyl 2-(2'-hydroxyphenyl)-2-oxazoline-4-carboxylate 82.35
C00027169 Trolline 82.35
C00027458 Oxyhydrastinine
N-Methylnoroxyhydrastinine		 82.35
C00030124 Dictagymnin 82.35
C00030433 Sordarial 82.35
C00030514 Integrifoliolin 82.35
C00031779 Ethyl 4-hydroxy-3-methoxycinnamate
Ethyl ferulate		 82.35
C00032286 Taraxafolin
(-)-Taraxafolin		 82.35
C00033338 Radicamine B
(+)-Radicamine B		 82.35
C00033516 1,3-Dihydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)propan-2-one 82.35
C00034327 (E)-Sinapic acid
trans-Sinapic acid
4-Hydroxy-3,5-dimethoxy-(E)-cinnamic acid		 82.35
C00034328 Sinapic acid methyl ester
trans-Sinapic acid methyl ester		 82.35
C00035212 2,3-Dihydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-1-propanone 82.35
C00035911 Benzyl hexanoate 82.35
C00036094 Cinnamyl isovalerate 82.35
C00036837 2,3-Dihydro-3-hydroxy-3-methylthiazolo[3,2-a]indole-9-carboxaldehyde
Brassicanal B		 82.35
C00037571 Ochratoxin beta 82.35
C00039894 Ocimarin 82.35
C00040015 Pichiacin B 82.35
C00042472 DIethyl phthalate 82.35
C00043132 (+)-(R)-(E)-3'-Hydroxyartemidin 82.35
C00045474 (+)-Cyclosordariolone 82.35
C00047149 4-(4'-Hydroxy-3'-methylbutoxy)benzaldehyde 82.35
C00047633 10,11-Dihydroanhydrobarakol
(+)-10,11-Dihydroanhydrobarakol		 82.35
C00048022 Norruspoline 82.35
C00050106 Gibbilimbol A 82.35
C00050107 Gibbilimbol B 82.35
Page Top