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


and

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




INPUT WORD = C00011927 , 50% or more
[ Metabolite Name : 3,7-Bis(hydroxymethyl)-1-benzoxepin-5(2H)-one ]
Number of matched data : 92

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00043717 Methyl taboganate 88.24
C00023270 1-[2-Hydroxy-5-(1-hydroxyethyl)phenyl]-3-methyl-2-buten-1-one 84.85
C00023271 2,2-Dimethyl-6-(1-hydroxyethyl)chroman-4-one 84.85
C00031268 Saikochromone A 84.85
C00043737 Montadial A 84.85
C00045656 Aristelegone B 84.85
C00045684 Bitalin A 84.85
C00040826 4-(3-Methyl-2-butenoxy)isonitrosoacetophenone 82.35
C00002399 6-Hydroxytremetone 81.82
C00002410 Toxol 81.82
C00002758 p-Methoxycinnamic acid ethyl ester 81.82
C00003012 Polygonolide 81.82
C00011199 4-(3-Indolyl)butane-1,2,3-triol 81.82
C00014954 NP 25301 81.82
C00016386 Methyl 2-(2'-hydroxyphenyl)-2-oxazoline-4-carboxylate 81.82
C00016417 1-Hydroxy-4-methoxy-2-naphthoic acid 81.82
C00017060 Antibiotic MI 43-37F11
Cytogenin		 81.82
C00018883 2,3,6-Trimethoxy-5-(1E)-1-propenylphenol 81.82
C00022703 2-Isovaleroyl-4-[1-hydroxyethyl]-phenol 81.82
C00022704 4-Hydroxy-3-isovalerylacetophenone 81.82
C00023264 4-Methoxy-3-(isopenten-2-yl)acetophenone 81.82
C00023266 2,2-Dimethyl-6-vinylchroman-4-one 81.82
C00026395 6-Methoxykynurenic acid 81.82
C00033026 Hydroxytremetone
(-)-Hydroxytremetone		 81.82
C00035486 3,4,5-Trimethoxycinnamyl alcohol
3',4',5'-Trimethoxycinnamyl alcohol		 81.82
C00036724 Ancistronaphthoic acid B 81.82
C00039752 Methyl 2,2-dimethyl-2H-1-chromene-6-carboxylate 81.82
C00041665 Coixlactam B
Methyl dioxindole-3-acetate
(-)-Methyl dioxindole-3-acetate		 81.82
C00042065 2,2-Dimethyl-6-methoxy-4-chromanone 81.82
C00043014 Sohirnone A 81.82
C00043145 1,6-Dihydroxy-8-methoxy-3,5-dimethylisochroman 81.82
C00043191 3'-Hydroxycorfin
(-)-3'-Hydroxycorfin		 81.82
C00045657 Aristelegone C
(-)-Aristelegone C		 81.82
C00046734 Eleutherolic acid 81.82
C00047149 4-(4'-Hydroxy-3'-methylbutoxy)benzaldehyde 81.82
C00048280 3,4-Dimethoxycinnamic acid methyl ester 81.82
C00015707 10-Norparvulenone 80.00
C00020090 Cadalenequinone
Stahlianthusone
8-Isopropyl-2,5-dimethyl-1,4-naphthoquinone		 80.00
C00033638 Ancistroquinone B 80.00
C00036347 (3S,4R)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane
(+)-(3S,4R)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane		 80.00
C00036348 (3S,4S)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane
(-)-(3S,4S)-6-Acetyl-3,4-dihydroxy-2,2-dimethylchromane		 80.00
C00034328 Sinapic acid methyl ester
trans-Sinapic acid methyl ester		 79.41
C00037321 Isobergapten 79.41
C00040885 Ataloxime A 79.41
C00040886 Ataloxime B 79.41
C00047336 Polygonophenone 79.41
C00049305 Sporovexin A
(-)-Sporovexin A		 79.41
C00001282 Eutypine 78.79
C00002395 Dehydrotremetone 78.79
C00002412 Tremetone 78.79
C00002427 Eupatoriochromene
Desmethylencecalin		 78.79
C00002699 4'-Hydroxy-3'-phenylacetophenone 78.79
C00002714 Apiol
Parsley apiole
Apiole		 78.79
C00002794 Aristolindiquinone 78.79
C00007571 Indolepyruvate
IPA
Indole pyruvate		 78.79
C00010525 Cerberic acid 78.79
C00011625 (+)-ar-Turmerone
(S)-ar-Turmerone
ar-Tumerone		 78.79
C00011641 Turmerone
(S)-2-Methyl-6-(4-methyl-1,4-cyclohexadien-1-yl)-2-hepten-4-one		 78.79
C00012570 (1R-cis)-4-(1,2-Dimethyl-3-methylenecyclopentyl)benzenemethanol
Laurenol		 78.79
C00012572 (1R-cis)-4-(1,2-Dimethyl-3-methylenecyclopentyl)benzaldehyde
Laurenal		 78.79
C00012576 (1R-cis)-4-(1,2-Dimethyl-3-methylenecyclopentyl)-1,4-cyclohexadiene-1-methanol
Isodihydrolaurenol		 78.79
C00016320 (E)-1-[3-(Chloromethylene)-2,3-dihydro-1-benzoxepin-7-yl]-ethanone
Pterulone
Pterulone A		 78.79
C00016847 Lachnumon 78.79
C00016848 Lachnumol A 78.79
C00018050 K 251-1
NSC 294978
Reticulol		 78.79
C00023267 2-Senecioyl-4-vinylphenol 78.79
C00023272 4-Methoxy-6-vinyl-2,3-dimethylchromene 78.79
C00029692 Anofinic acid
1-Hydroxy-3',3'-dimethylchromene		 78.79
C00029766 Baccharisketone 78.79
C00029831 Bisacumol
(+)-Bisacumol		 78.79
C00030226 Eugenin 78.79
C00030228 Euparin 78.79
C00031439 Yunngnin B 78.79
C00031786 Ficusol
(-)-Ficusol
Methyl (S)-2-(4-hydroxy-3-methoxyphenyl)-3-hydroxypropanoate		 78.79
C00032011 Methyl cis-ferulate 78.79
C00033338 Radicamine B
(+)-Radicamine B		 78.79
C00034924 4-Hydroxy-5-methoxy-2-naphthaldehyde 78.79
C00035053 ar-Turmerol 78.79
C00039177 Eugenetin 78.79
C00039184 Evofolin C 78.79
C00040304 Siderin 78.79
C00042149 5,7-Dimethoxychromone 78.79
C00042603 Hyrtioerectine C 78.79
C00043132 (+)-(R)-(E)-3'-Hydroxyartemidin 78.79
C00043172 2-Methoxy-7-methyljuglone 78.79
C00043192 3-Methoxy-7-methyljuglone 78.79
C00043194 3-Methoxyjuglone
5-Hydroxy-3-methoxy-1,4-naphthoquinone		 78.79
C00043284 Artemidinol 78.79
C00044317 Sparanone B
(-)-Sparanone B		 78.79
C00045474 (+)-Cyclosordariolone 78.79
C00045658 Aristelegone D
(-)-Aristelegone D		 78.79
C00049232 Mompain 78.79
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