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


and

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




INPUT WORD = C00022429 , 50% or more
[ Metabolite Name : Rupestralic acid ]
Number of matched data : 83

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00022433 13-Hydroxyballonigrinolide 92.73
C00031513 15-Methoxypinusolidic acid
(+)-15-Methoxypinusolidic acid		 92.73
C00035425 Velutine C 92.73
C00043919 Sibiricinone C
(+)-Sibiricinone C		 91.07
C00022288 Ballonigrinone 90.91
C00022289 18-Hydroxyballonigrine 90.91
C00038325 7R-Hydroxy-14-deoxyandrographolide 90.91
C00038326 7S-Hydroxy-14-deoxyandrographolide 90.91
C00042055 15-epi-Leopersin O 90.91
C00042056 15-epi-Leopersin Q 90.91
C00042690 Leopersin O 90.91
C00042691 Leopersin Q 90.91
C00043917 Sibiricinone A
(+)-Sibiricinone A		 90.91
C00046593 Labda-8(17),11,13-trien-15(16)-olide
(+)-Labda-8(17),11,13-trien-15(16)-olide		 90.91
C00050375 Leopersin H
(+)-Leopersin H		 90.91
C00022266 Peregrinin 89.09
C00022287 Ballonigrin
Ballonigrine		 89.09
C00022391 Ballotinone
7-Oxomarrubiin		 89.09
C00022394 Ballotenol 89.09
C00022770 Pinusolidic acid 89.09
C00022771 Pinusolide 89.09
C00023344 Nivenolide 89.09
C00023367 Isodihydroclutiolide 89.09
C00029399 15-Ethoxy-hedyforrestin D 89.09
C00030462 Hedyforrestin D 89.09
C00030660 Limbatenolide D 89.09
C00031373 Shinjulactone H 89.09
C00039603 Langduin B
(-)-Langduin B		 89.09
C00041244 14-Deoxy-17-hydroxyandrographolide
(-)-14-Deoxy-17-hydroxyandrographolide		 89.09
C00041663 Marrulibanoside 89.09
C00043603 Hypopurin D
(+)-Hypopurin D		 89.09
C00046796 CID is old! 89.09
C00050379 Leopersin L
(-)-Leopersin L		 89.09
C00048254 15-Methoxyvelutine C
(+)-15-Methoxyvelutine C		 88.14
C00020487 [3aS-(3aalpha,4alpha,5alpha,9aalpha,9bbeta)]-5-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-6-methyl-3,9-bis(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester 2-methylpropanoic acid 87.50
C00000083 Gibberellin A83
GA83		 87.27
C00003452 Marrubiin 87.27
C00003708 Chaparrolide 87.27
C00011782 Mollisorin B 87.27
C00011808 2,3,3a,4,5,8,9,11a-Octahydro-5,9-dihydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-methyl-butanoic acid 87.27
C00011859 (3aR,4R,6E,10Z,11aR)-6-Formyl-2,3,3a,4,5,8,9,11a-octahydro-10-(hydroxymethyl)-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-methylbutanoic acid 87.27
C00012053 [3aS-[3aalpha,4alpha,5beta(Z),6beta,7alpha,7aalpha]]-6-Ethenyloctahydro-3a,4-dihydroxy-6-methyl-3-methylene-7-(1-methylethenyl)-2-oxo-5-benzofuranyl ester 2-methyl-2-butenoic acid 87.27
C00012228 6-Formyl-2,3,3a,4,5,8,9,11a-octahydro-5-hydroxy-10-(hydroxymethyl)-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-methylbutanoic acid 87.27
C00012256 Montafrusin
Montafrusin A		 87.27
C00012257 (+)-Montafrusin B
Montafrusin B		 87.27
C00012258 Zoapatanolide A 87.27
C00012984 (+)-Tirotundifolin A
Tirotundifolin A		 87.27
C00012986 Trichomatolide D
(3aR,4R,5aR,6R,9aS,9bR)-[partial]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 3-hydroxy-2-methylenebutanoic acid		 87.27
C00022217 Leonotinin 87.27
C00022230 Phlogantholide A 87.27
C00022232 14-Deoxyandrographolide 87.27
C00022240 14-Deoxy-11,14-didehydroandrographolide 87.27
C00022255 14-Deoxy-11-oxoandrographolide 87.27
C00022392 Leonotin 87.27
C00022769 ent-8(17),13-Labdadien-15,16-olid-18-oic acid 87.27
C00023301 Acetylimbricatolic acid 87.27
C00023363 Wightionolide 87.27
C00023366 Dihydroclutiolide 87.27
C00029683 Andrographic acid 87.27
C00030661 Limbatenolide E
(+)-Limbatenolide E		 87.27
C00031616 Bacchariol
(-)-Bacchariol		 87.27
C00031972 Leopersin C 87.27
C00034921 Zambesiacolactone B
(+)-Zambesiacolactone B		 87.27
C00035207 15-epi-Cyllenine A 87.27
C00035287 Cyllenine A 87.27
C00038155 12R,13R-Hydroxyandrographolide 87.27
C00038156 12S,13S-Hydroxyandrographolide 87.27
C00038174 17-Hydroxyjolkinolide B 87.27
C00041247 15-epi-Cyllenin A 87.27
C00041472 Cyllenin A 87.27
C00041603 isoandrographolide 87.27
C00042404 Coetsanoic acid 87.27
C00042553 Gelomulide J 87.27
C00043123 Zerumin B 87.27
C00043159 15-epi-Sibiricinone D 87.27
C00043160 15-epi-Sibiricinone E 87.27
C00043601 Hypopurin B
(+)-Hypopurin B		 87.27
C00043920 Sibiricinone D 87.27
C00043921 Sibiricinone E 87.27
C00048283 3alpha-Hydroxymarrubiin
(+)-3alpha-Hydroxymarrubiin		 87.27
C00050317 15-epi-Leopersin J 87.27
C00050377 Leopersin J 87.27
C00050378 Leopersin K
(-)-Leopersin K		 87.27
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