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


and

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





INPUT WORD = C00002453 , 50% or more
[ Metabolite Name : (+)-Byakangelicin , Byakangelicin ]
Number of matched data : 76

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00032665 5-O-(3-Chloro-2-hydroxy-3-methylbutyl)-8-methoxypsoralen 96.00
C00036599 5-Methoxy-8-(1,1-dimethyl-2,3-dihydroxypropyl)-psoralen
(+)-5-Methoxy-8-(1,1-dimethyl-2,3-dihydroxypropyl)-psoralen
94.00
C00037262 Heraclenol 92.00
C00036590 5,8-Dimethoxy-3-(3-methyl-2,3-dihydroxybutyl)-psoralen
(-)-5,8-Dimethoxy-3-(3-methyl-2,3-dihydroxybutyl)-psoralen
90.38
C00029597 8-(3-Chloro-2-hydroxy-3-methylbutoxy)psoralen
(+)-8-(3-Chloro-2-hydroxy-3-methylbutoxy)psoralen
90.00
C00030905 Oxypeucedanin hydrate
Aviprin
(+)-Aviprin
(+)-Oxypeucedanin hydrate
90.00
C00030987 Phellopterin 90.00
C00035023 5-Methoxy-3-(3-methyl-2,3-dihydroxybutyl)psoralen
(-)-5-Methoxy-3-(3-methyl-2,3-dihydroxybutyl)-psoralen
90.00
C00035717 CID is old! 90.00
C00036625 6-Methoxy-5-(3-methyl-2,3-dihydroxybutyl)-angelicin 90.00
C00035181 Murrayacoumarin A 88.24
C00019805 Buntansin C 88.00
C00030531 Isogosferol
Isogospherol
(+)-Isogospherol
88.00
C00032846 Cnidilin
Knidilin
Isophellopterin
88.00
C00037261 Heraclenin 88.00
C00037483 Marmin 88.00
C00039186 Excavatin B
(+)-Excavatin B
88.00
C00043800 Oxyimperatorin 88.00
C00044030 (+)-6-(2-Hydroxy-3-methoxy-3-methylbutyl)-5,7-dimethoxycoumarin 88.00
C00037146 Fesumtuorin B
(+)-Fesumtuorin B
87.50
C00033583 7-(2'-Hydroxy-3'-chloroprenyloxy)-4,8-dimethoxyfuroquinoline 86.54
C00019840 (-)-7-(6,7-Dihydroxy-3,7-dimethyl-5-oxooctanoxy)-coumarin 86.27
C00020006 Praealtin D 86.27
C00026429 Foliphorin 86.27
C00002458 Cichoriin 86.00
C00002490 Oxypeucedanin 86.00
C00019829 5-Deoxyprotobruceol II regioisomer 86.00
C00019830 5-Deoxyprotobruceol III regioisomer 86.00
C00019846 7-(2,3-Dihydroxy-3-methylbutyloxy)-5-hydroxy-6-methoxycoumarin 86.00
C00019865 (+)-7-(6,7-Epoxy-3,7-dimethyl-5-oxooctanoxy)-coumarin 86.00
C00019891 (E)-7-(6-Hydroperoxy-3,7-dimethylocta-2,7-dienyloxy)coumarin 86.00
C00019948 6-Methoxy-3',4'-dehydromurranganon 86.00
C00019964 trans-O-Methylgrandmarin 86.00
C00031473 (S)-(-)-Oxypeucedanin 86.00
C00032165 Skimmin
(-)-Skimmin
86.00
C00036179 Nigrolineaxanthone D 86.00
C00037003 Daphnin 86.00
C00037165 Furopinnarin 86.00
C00043620 Isoptelefolidine
(+)-Isoptelefolidine
86.00
C00043797 Orixine
(+)-Orixine
86.00
C00043846 Preorixine 86.00
C00045368 Phebaclavin G
(-)-Phebaclavin G
86.00
C00037145 Fesumtuorin A
(+)-Fesumtuorin A
85.71
C00023619 Aflatoxin G2 84.62
C00023620 Aflatoxin M1 84.62
C00026426 Evolatine 84.62
C00043077 trans-Avicennol 84.62
C00002421 Cimifugin 84.00
C00004637 Caryatin
3,5-Di-O-Methylquercetin
2-(3,4-Dihydroxyphenyl)-7-hydroxy-3,5-dimethoxy-4H-1-benzopyran-4-one
84.00
C00019881 cis-Grandmarin 84.00
C00019896 7-(6R-Hydroxy-3,7-dimethylocta-2,5-dienyl)-7-hydroxycoumarin 84.00
C00019967 Murraculatin 84.00
C00019987 Omphalocarpin 84.00
C00026398 7,8-Dimethoxymyrtopsine
(+)-7,8-Dimethoxymyrtopsine
84.00
C00026425 Evodine
7-(2-Hydroxy-3-methylbut-3-enyl)oxy-8-methoxydictamnine
84.00
C00026427 Evoxoidine
7-(3-Methylbutan-2-only)oxy-8-methoxydictamnine
84.00
C00030835 Nordentatin 84.00
C00033364 Saxalin 84.00
C00036120 Greveiglycol 84.00
C00036287 (-)-Prantschimgin 84.00
C00036518 3,5-Dimethoxy-3-(1,1-dimethylprop-2-enyl)-3,4-dihydropsoralen-4-one 84.00
C00037142 Ferulagol B 84.00
C00037872 Swietenocoumarin B 84.00
C00038543 Avicennone B
(-)-Avicennone B
84.00
C00039185 Excavatin A
(+)-Excavatin A
84.00
C00039187 Excavatin C
(+)-Excavatin C
84.00
C00039451 Isopurpurasol
(+)-Isopurpurasol
84.00
C00043481 E-Imperatorin acid 84.00
C00043493 E-Trichoclin
Trichoclin
84.00
C00043597 Hyperxanthone D
(-)-Hyperxanthone D
84.00
C00043798 Orixinone 84.00
C00044024 Z-Imperatorin acid 84.00
C00044026 Z-Trichoclin 84.00
C00044035 (+)-Toddanol 84.00
C00044063 4-Hydroxy-5-methylcoumarin 4-O-beta-D-glucopyranoside
Gerberinside
84.00
C00044349 Toddanone 84.00
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