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


and

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




INPUT WORD = C00044603 , 50% or more
[ Metabolite Name : Butyl chlorogenate ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00044753 Ethyl chlorogenate 93.22
C00047405 Brevipolide C
(+)-Brevipolide C		 91.67
C00047406 Brevipolide D
(+)-Brevipolide D		 90.00
C00029558 5-Caffeoylquinic acid methyl ester 89.83
C00029948 Chlorogenic acid methyl ester
Methyl 5-O-caffeoylquinate
Methyl chlorogenate		 89.83
C00032918 Dracunculifoside E
(-)-Dracunculifoside E		 89.83
C00035932 3-Caffeoylquinic acid methyl ester
3-O-Caffeoylquinic acid methyl ester		 89.83
C00042501 Ethyl 4-O-caffeoylquinate 89.83
C00033048 Hymenoside V
(+)-Hymenoside V		 88.52
C00030769 Methyl-3-O-feruloylquinate 88.14
C00042739 Methyl-4-O-caffeoylquinate
(+)-Methyl-4-O-caffeoylquinate		 88.14
C00047408 Brevipolide F
(+)-Brevipolide F		 88.14
C00033041 Hymenoside O
(-)-Hymenoside O		 87.30
C00042873 Pubescenoside B
(-)-Pubescenoside B		 87.30
C00002749 Grandidentatin 87.10
C00018705 Cervicarcin
NSC 65380		 86.67
C00039468 Itoside I
(-)-Itoside I		 86.67
C00002724 3-O-Caffeoylquinic acid
Chlorogenic acid
Chlorogenate
Heriguard
Caffeoylquinic acid		 86.44
C00010768 Jasmolactone B 86.44
C00030807 Neochlorogenic acid
5-O-Caffeoylquinic acid
Caffeoylquinic acid
5-Caffeoylquinic acid		 86.44
C00035939 Feruloylquinic acid
3-O-Feruloylquinic acid
3-Ferulylquinic acid		 86.44
C00049091 5-Caffeoyl quinic acid
(+)-5-Caffeoyl quinic acid		 86.44
C00031195 Rossicasin A
(-)-Rossicasin A		 85.94
C00031196 Rossicasin B
(-)-Rossicasin B		 85.94
C00029275 (-)-3'-Methoxy specinonin 85.71
C00031042 Piscrocin G
(-)-Piscrocin G		 85.71
C00033040 Hymenoside N
(-)-Hymenoside N		 85.71
C00033042 Hymenoside P
(-)-Hymenoside P		 85.71
C00042872 Pubescenoside A
(-)-Pubescenoside A		 85.71
C00031184 Rosarin 85.48
C00012311 Neurolenin B 85.25
C00037551 Nigrumin-5-p-coumarate 85.25
C00017857 WF 10129 85.00
C00045024 Polygalolide B
(-)-Polygalolide B		 85.00
C00003472 Plaunol D 84.75
C00009747 Abruquinone B
6,7,8,3',4'-Pentamethoxyisoflavanquinone		 84.75
C00012309 Calein D 84.75
C00021381 4beta,8beta,2alpha-Trihydroxy-6alpha-p-hydroxybenzoyloxydaucane 84.75
C00021962 Vernoeggersic acid 84.75
C00029540 Cryptochlorogenic acid
4-Caffeoylquinic acid
4-O-Caffeoylquinic acid		 84.75
C00033043 Hymenoside Q
(-)-Hymenoside Q		 84.75
C00035449 [8]-Gingerdiol 84.75
C00042735 methyl 4-O-coumaroylquinate 84.75
C00045023 Polygalolide A
(-)-Polygalolide A		 84.75
C00046483 Tupuseleiamide B 84.75
C00049590 Neurolenin G 84.75
C00030899 Osmanthuside H
(-)-Osmanthuside H		 83.87
C00031185 Rosavin 83.87
C00041784 Polygalatenoside A
(+)-Polygalatenoside A		 83.87
C00012307 Calein B 83.61
C00021349 8-Coumaroyloxy-14-thapsanol 83.61
C00021413 2,3-Epoxyjaeschkeanadiol 5alpha-vanillate 83.61
C00027714 1-O-(3-Hydroxybutyryl)pancratistatin 83.61
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