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


and

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





INPUT WORD = C00010222 , 50% or more
[ Metabolite Name : 5-Hydroxy-6'',6''-dimethyl-6-(2-methylbutyryl)-4-phenylpyrano[2'',3'':7,8]coumarin , MAB5 ]
Number of matched data : 54

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00046114 Mammea A/AB cyclo D 100.00
C00010216 Tomentolide A 96.88
C00010210 6-Butyryl-5-hydroxy-4-phenylseselin 96.83
C00010221 Mammeigin
5-Hydroxy-6'',6''-dimethyl-6-(3-methylbutyryl)-4-phenylpyrano[2'',3'':7,8]coumarin
Mammea A/A cyclo D
96.83
C00010223 Mammea A/AD cyclo D
Mesuagin
96.83
C00041051 Mammea A/AC cyclo D 96.83
C00046215 Ochrocarpin A
(-)-Ochrocarpin A
95.38
C00035840 Inophyllum C 95.31
C00044815 Inophyllum A
(+)-Inophyllum A
95.31
C00044816 Inophyllum D
(+)-Inophyllum D
95.31
C00010219 5,7-Dihydroxy-8-(3-methylbut-2-enyl)-6-(2-methylbutyryl)-4-phenylcoumarin 95.24
C00046217 Ochrocarpin C 95.24
C00010215 Apetalolide 93.85
C00010225 1,2-Dihydro-5-hydroxy-2-(1-hydroxy-1-methylethyl)-4-(2-methylbutyryl)-6-phenylfurano[2,3-h][1]benzopyran-8-one
MAB3
93.85
C00046216 Ochrocarpin B
(-)-Ochrocarpin B
93.85
C00010213 Inophyllum E
cis-and-trans-Inophyllolide
93.75
C00010214 Inophyllolide chromanol 93.75
C00010226 1,2-Dihydro-5-hydroxy-2-(1-hydroxy-1-methylethyl)-4-(isobutyryl)-6-phenylfurano[2,3-h][1]benzopyran-8-one 93.65
C00010227 1,2-Dihydro-5-hydroxy-2-(1-hydroxy-1-methylethyl)-4-(butyryl)-6-phenylfurano[2,3-h][1]benzopyran-8-one 93.65
C00041052 Mammea A/AC cyclo F 93.65
C00045862 Disparacetylfuran A 93.65
C00046218 Ochrocarpin D
(-)-Ochrocarpin D
92.54
C00002455 Calophyllolide 92.31
C00004045 Fulvinervin C
(E)-5-Hydroxy-6-(3-hydroxy-3-methyl-1-butenyl)-8,8-dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
5-Hydroxy-6-[(1E)-3-hydroxy-3-methyl-1-butenyl]-8,8-dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
92.06
C00010211 Mammea A/AC 92.06
C00010229 Mammea A/BB
5,7-Dihydroxy-6-(3-methylbut-2-enyl)-8-(2-methylbutyryl)-4-phenylcoumarin
92.06
C00004044 Fulvinervin B
(E)-5-Hydroxy-8,8-dimethyl-6-(3-methyl-1,3-butadienyl)-2-phenyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
5-Hydroxy-8,8-dimethyl-6-[(1E)-3-methyl-1,3-butadienyl]-2-phenyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
90.48
C00004093 Laxifolin
5-Hydroxy-2-(4-hydroxyphenyl)-8,8-dimethyl-6-(3-methyl-2-butenyl)-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
90.48
C00010217 Calaustralin 90.48
C00010220 Mesuol
5,7-Dihydroxy-8-(3-methylbut-2-enyl)-6-isobutyryl-4-phenylcoumarin
90.48
C00044571 Brasimarin C
(+)-Brasimarin C
90.48
C00046219 Ochrocarpin E 90.48
C00047462 Isoracemosol 90.48
C00009943 Euchrenone b8 89.23
C00009948 Euchrenone b9 89.23
C00010269 Calophyllic acid 89.23
C00042383 Chapelieric acid 89.23
C00010047 Isorobustin 4-methyl ether
4-O-Methylisorobustin
89.06
C00014392 MS II
3-Hydroxy-bis(6'',6''-dimethylpyrano[2'',3'':5,6][2'',3'':7,8]flavanone
89.06
C00019378 Erythrivarone B 89.06
C00002555 Osajin 88.89
C00009517 Toxicarolisoflavone 88.89
C00010228 5,7-Dihydroxy-6-(3-methylbut-2-enyl)-8-(3-methylbutyryl)-4-phenylcoumarin
Mammea A/BA
88.89
C00014225 Spinoflavanone A
5-Hydroxy-6-(3-methyl-1,3-butadienyl)-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone
88.89
C00014236 Cycloaltilisin 7
5,4'-Dihydroxy-6''-methyl,6''-(4-methylpent-3-enyl)-pyrano[2'',3'':7,8]flavanone
88.89
C00004059 Morusinol
Oxydihydromorusin
2-(2,4-Dihydroxyphenyl)-5-hydroxy-3-(3-hydroxy-3-methylbutyl)-8,8-dimethyl-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one
88.06
C00009518 Scandinone
Nallanin
87.69
C00009520 Isoauriculasin 87.69
C00009944 Euchrenone b6 87.69
C00009949 Euchrenone b7 87.69
C00010224 1,2-Dihydro-5-hydroxy-2-(1-hydroxy-1-methylethyl)-4-(3-methylbutyryl)-6-phenylfurano[2,3-h][1]benzopyran-8-one 87.69
C00019442 O-Demethylcyclogangetin 87.69
C00044570 Brasimarin B
(+)-Brasimarin B
87.69
C00049018 Teysmanone B 87.69
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