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


and

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




INPUT WORD = C00002995 , 50% or more
[ Metabolite Name : Heritonin ]
Number of matched data : 80

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00020097 Heritol 95.00
C00030734 Mansorin II
(-)-Mansorin II		 90.00
C00020176 8-Acetoxy-3-methoxycalamenene
(1S,3R,4R)-7-Methoxycalamenen-3-yl acetate		 88.37
C00020178 3-Acetoxy-8-calamenenone
(1S,4R)-7-Acetoxycalamenen-3-one		 87.80
C00030728 Mansonone N
(+)-Mansonone N		 87.80
C00020175 3-Methoxy-8-calamenenol
(1S,3R,4R)-7-Methoxycalamenen-3-ol		 87.50
C00020179 3-Methoxy-8-calamenenone
(1S,4R)-7-Methoxycalamenen-3-one		 87.50
C00034300 Taraxacin
(-)-Taraxacin		 87.50
C00034499 Engelharolide
(+)-Engelharolide		 87.50
C00049252 Parahigginol C
(-)-Parahigginol C		 87.50
C00021658 7-Hydroxy-10-ethoxydehydrodihydrobotrydial 85.71
C00034773 6,7,9alpha-Trihydroxy-3,8,11alpha-trimethylcyclohexo[d,e]-coumarin
(+)-6,7,9.alpha.-Trihydroxy-3,8,11alpha-trimethylcyclohexo[d,e]coumarin		 85.71
C00002456 Chalepensin 85.00
C00003396 Xeratholide 85.00
C00010815 7-Isobutyryloxythymohydroquinone dimethyl ether 85.00
C00013209 Isosmyrnicordiolide
4a,9a,10,10a-Tetrahydro-3,5,9a-trimethylfuro[2,3-h][3]benzoxepin-2(4H)-one		 85.00
C00020180 (1S,3R,4R)-Calamenene-3,4,7-triol 85.00
C00020185 (1S,4S)-7-Methoxycalamenen-3-one 85.00
C00020768 9-Hydroxyverboccidentalactone 85.00
C00020773 (1S,4R)-7-Methoxycalamenen-4-ol 85.00
C00020774 (1S,3R,4S)-Calamenene-3,4,7-triol 85.00
C00020942 Mikanokryptin 85.00
C00020950 Achalensolide
8-Epixerantholide		 85.00
C00021655 7-Hydroxy-10-oxodehydrodihydrobotrydial 85.00
C00021656 7,10-Dihydroxydehydrodihydrobotrydial 85.00
C00021925 Isoparvifolinone 85.00
C00022590 CID is old! 85.00
C00030729 Mansonone O
(-)-Mansonone O		 85.00
C00030731 Mansorin A
Mansonrin A		 85.00
C00033536 1alpha-Hydroxyxerantholide 85.00
C00035445 [4]-Isogingerol 85.00
C00036006 3',4'-Dimethoxycinnamyl isovalerate 85.00
C00046123 Mansonone Q
(+)-Mansonone Q		 85.00
C00011688 3-(Acetyloxy)-5-(1,5-dimethyl-4-hexenyl)-2-methyl-2,5-cyclohexadiene-1,4-dione 83.33
C00020769 9-Methoxyverboccidentalactone 83.33
C00012050 Deoxysericealactone 82.93
C00016865 3097B1 82.93
C00038857 Coumarleucasin 82.93
C00048296 7-Chloro-8-hydroxy-6-methoxy-3-pentylisocoumarin 82.93
C00002029 Codonopsine 82.50
C00003158 Lacinilene C 7-methyl ether 82.50
C00003289 Geigerin 82.50
C00007169 Lucidone 82.50
C00012531 (-)-Tochuinyl acetate
Tochuinol acetate
Tochuinyl acetate		 82.50
C00012532 (1R,2R)-1,2-Dimethyl-2-(4-methyl-1,4-cyclohexadien-1-yl)cyclopentanemethanol acetate
Dihydrotochuinyl acetate		 82.50
C00012559 (2alpha,3alpha,4beta,5alpha)-(+)-7-Bromo-2,3,4,5-tetrahydro-4,5,8-trimethyl-2,5-Methano-1-benzoxepin-3-carboxaldehyde
Caraibical		 82.50
C00019925 3-(3-Hydroxy-3-methyl-trans-but-1-enyl)-7-methoxycoumarin 82.50
C00020075 5-Hydroxy-8-methoxycalamenene 82.50
C00020079 3-Hydroxy-14-calamenoic acid 82.50
C00020168 3,5-Dihydro-8-hydroxy-5-isopropyl-2,7-dimethyl-1-benzoxepin-4(2H)-one 82.50
C00020174 (1S,3R,4S)-Calamenene-3,7-diol 82.50
C00020230 2-Oxoverboccidentafuran 82.50
C00020350 3-Chloro-2-oxo-1(10),3,7(11),8-guiatetraen-12,6-olide 82.50
C00020427 Pechueloic acid 82.50
C00020909 Geigeriafulvenolide 82.50
C00020949 Thieleanine 82.50
C00020951 3-Oxo-4-guaien-12,8beta-olide 82.50
C00020952 Ferulin 82.50
C00021015 3alpha-Methoxy-desoxo-achalensolide 82.50
C00021017 3beta-Methoxy-desoxo-achalensolide 82.50
C00021101 [3aR-(3aalpha,6alpha,8abeta,9aalpha)]-3a,4,6,7,8,8a,9,9a-Octahydro-6-hydroxy-5,8a-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one 82.50
C00021102 2alpha-Hydroxy-eudesm-3,11(13)-dien-12,8beta-olide 82.50
C00021107 Cooperin 82.50
C00029296 (+)-Codonopsine 82.50
C00030735 Mansorin III 82.50
C00032156 Sinodielide G
(+)-Sinodielide G		 82.50
C00035444 [4]-Gingerol 82.50
C00037239 Heliannuol A
(-)-Heliannuol A		 82.50
C00037241 Heliannuol D
(+)-Heliannuol D		 82.50
C00037243 Heliannuol F
(+)-Heliannuol F		 82.50
C00037246 Heliannuol I
(-)-Heliannuol I		 82.50
C00038333 8-Methoxycoumarsabin 82.50
C00039357 Heliannuol J
(+)-Heliannuol J		 82.50
C00040054 Populene E
(+)-Populene E		 82.50
C00040055 Populene F
(+)-Populene F		 82.50
C00041759 p-Hydroxyphenopyrrozin
(+)-p-Hydroxyphenopyrrozin		 82.50
C00046557 12-Hydroxydehydrobotrydienol
(+)-12-Hydroxydehydrobotrydienol		 82.50
C00047775 Candenatenin C
(-)-Candenatenin C		 82.50
C00049484 Morinin B 82.50
C00049723 Heliannuol K
(+)-Heliannuol K		 82.50
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