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


and

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




INPUT WORD = C00020337 , 50% or more
[ Metabolite Name : Isoxanthanol , 4-Acetylivalbin ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00000313 Xanthinin 97.78
C00003395 Xanthumin 95.56
C00020336 Xanthanol
Xanthumanol
2-Acetylivalbin		 95.56
C00020343 Inuchinenolide A 95.56
C00012333 Chrysanolide
Tamirin acetate		 93.33
C00012390 Calbertolide A 93.33
C00020896 Maxicanin G 91.49
C00012869 Dihydro-beta-cyclopyrethrosin
[3R-(3alpha,3aalpha,4alpha,4aalpha,8beta,8abeta,9abeta)]-4-(Acetyloxy)decahydro-8-hydroxy-3,8a-dimethyl-5-methylene-naphtho[2,3-b]furan-2(3H)-one		 91.30
C00012873 Pulchellin E
[3aR-(3aalpha,4aalpha,6beta,7alpha,8abeta,9aalpha)]-6-(Acetyloxy)decahydro-7-hydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one		 91.30
C00012961 Montathanolide
[3aS-(3aalpha,5abeta,6beta,8beta,9bbeta)]-8-(Acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 91.30
C00012993 [3aR-(3aalpha,5abeta,7alpha,9balpha)]-7-(Acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-3a-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one 91.30
C00013002 Torrentin
[3S-(3alpha,3aalpha,5abeta,6beta,8beta,9bbeta)]-8-(Acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-6-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 91.30
C00013074 8alpha-Acetoxytaurin
(3S,3aS,5aR,8R,9bS)-8-(Acetyloxy)-3a,5,5a,7,8,9b-hexahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,6(3H,4H)-dione		 91.30
C00020882 Inuchinenolide B 91.30
C00020887 Neogaillardin
Pleniradin acetate		 91.30
C00020930 6alpha-Acetoxy-4alpha-hydroxy-9,11(13)-guaiadien-12,8alpha-olide 91.30
C00021069 6-Deoxychamissonolide 91.30
C00021071 Stevin 91.30
C00021091 Hysterin 91.30
C00021094 4-Acetoxyrudmollin 91.30
C00035781 15-O-Acetylamphoricarpolide 91.30
C00003343 Ovatifolin 91.11
C00011755 Herbolide D 91.11
C00011783 Chihuahuin 91.11
C00012221 Argentiolide B 91.11
C00012922 Acetoxydiplophyllin
[3aS-(3aalpha,8abeta,9beta,9aalpha)]-9-(Acetyloxy)-3a,4,6,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 91.11
C00012933 [3aR-(3aalpha,4aalpha,6beta,8abeta,9aalpha)]-6-(Acetyloxy)-3a,4,4a,5,6,8a,9,9a-octahydro-8a-methyl-3,5-bis(methylene)naphtho[2,3-b]furan-2(3H)-one 91.11
C00013043 [3aS-(3aalpha,5abeta,7alpha,9balpha)]-7-(Acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
2alpha-Acetoxysphaerantholide		 91.11
C00013048 [3aS-(3aalpha,5beta,5abeta,9balpha)]-5-(Acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
9beta-Acetoxytournefortiolide		 91.11
C00013057 beta-Cyclotulipinolide
[3aR-(3aalpha,4alpha,5abeta,9aalpha,9bbeta)]-4-(Acetyloxy)decahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one		 91.11
C00020916 3beta-Acetoxy-1(5),11(13)-guaiadien-12,8alpha-olide 91.11
C00021018 3beta-Acetoxy-desoxo-achalensolide 91.11
C00021044 Apachin 91.11
C00022675 14-Acetoxy-11alpha,13-dihydrodesoxyivangustin 91.11
C00012246 [7S-(5Z,7R*,9R*,10E,11aS*)]-9-(acetyloxy)-7,8,9,11a-tetrahydro-7-hydroxy-3-(hydroxymethyl)-6,10-dimethylcyclodeca[b]furan-2(4H)-one,
13-Desacetyl-1beta-hydroxyafraglaucolide		 89.36
C00003217 Arnicolide A 89.13
C00003288 Gaillardin 89.13
C00003319 Lipiferolide 89.13
C00012102 Lanuginolide 89.13
C00012199 Herbolide B 89.13
C00012864 [3aR-(3aalpha,7alpha,8beta,8abeta,9abeta)]-7-(acetyloxy)-3a,4,6,7,8,8a,9,9a-octahydro-8-hydroxy-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one
2alpha-Acetoxy-8-epiivangustin		 89.13
C00012866 (+)-beta-Cyclopyrethrosin
beta-Cyclopyrethrosin
[3aR-(3aalpha,4alpha,4aalpha,8beta,8abeta,9abeta)]-4-(Acetyloxy)decahydro-8-hydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one		 89.13
C00012872 Pulchellin B
[3aR-(3aalpha,4aalpha,6beta,7alpha,8abeta,9aalpha)]-7-(Acetyloxy)decahydro-6-hydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one		 89.13
C00012982 beta-Liriodenolide
[3aR-(3aalpha,4beta,5abeta,6beta,9aalpha,9bbeta)]-4-(Acetyloxy)decahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-naphtho[1,2-b]furan-2(3H)-one		 89.13
C00012990 [3aS-(3aalpha,5abeta,7alpha,9aalpha,9balpha)]-7-(Acetyloxy)decahydro-9a-hydroxy-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one 89.13
C00012997 Nitrosin
[3R-(3alpha,3abeta,5aalpha,6alpha,9abeta,9balpha)]-6-(Acetyloxy)decahydro-9a-hydroxy-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2(3H)-one		 89.13
C00013060 (+)-Artegallin
Artegallin
[3R-(3alpha,3abeta,5aalpha,6beta,9balpha)]-6-(Acetyloxy)-3a,5,5a,6,7,9b-hexahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 89.13
C00020472 Michefuscalide
beta-Cyclolipiferolide		 89.13
C00020946 6-Acetylferulidin 89.13
C00021078 4beta-Acetoxy-6alpha-hydroxy-11(13)-pseudoguaien-12,8alpha-olide 89.13
C00021786 8beta-Acetoxy-9(12)-capnellene-8beta,10alpha,14-triol 89.13
C00033757 Dehydrolanuginolide 89.13
C00046477 Tubipolide C
(-)-Tubipolide C		 89.13
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