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


and

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




INPUT WORD = C00041308 , 50% or more
[ Metabolite Name : Acetyl neobritannilactone B ]
Number of matched data : 62

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00003379 epi-Tulipinolide 97.67
C00011783 Chihuahuin 95.56
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		 95.45
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		 95.45
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		 95.45
C00003378 Tulipinolide 95.35
C00012037 Epitulipdienolide
Elemanolide		 95.35
C00012198 Herbolide A 95.35
C00003343 Ovatifolin 93.33
C00011755 Herbolide D 93.33
C00011757 (+)-Heliangolidin
Heliangolidin		 93.33
C00020884 Puberolide 93.18
C00021023 15-Acetoxy-11beta,13-dihydroziniolide 93.18
C00012185 Novanin 93.02
C00012387 [3aR-(3aR*,5Z,9E,11aS*)]-6-[(Acetyloxy)methyl]-3a,4,7,8,11,11a-hexahydro-10-methyl-3-methylenecyclodeca[b]furan-2(3H)-one 93.02
C00012199 Herbolide B 91.30
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
C00012978 gamma-Liriodenolide
[3aR-(3aalpha,4beta,5abeta,6beta,9bbeta)]-4-(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
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		 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
C00020472 Michefuscalide
beta-Cyclolipiferolide		 91.30
C00020887 Neogaillardin
Pleniradin acetate		 91.30
C00020930 6alpha-Acetoxy-4alpha-hydroxy-9,11(13)-guaiadien-12,8alpha-olide 91.30
C00012221 Argentiolide B 91.11
C00012329 Tulirinol 91.11
C00012333 Chrysanolide
Tamirin acetate		 91.11
C00012390 Calbertolide A 91.11
C00020343 Inuchinenolide A 91.11
C00021700 9beta-Propionyloxy costunolide 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		 90.91
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 90.91
C00013053 1alpha-Acetoxy-11beta(H),13-dihydrodouglanin
[3S-(3alpha,3aalpha,5abeta,6alpha,9aalpha,9bbeta)]-6-(Acetyloxy)-3a,4,5,5a,6,7,9a,9b-octahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 90.91
C00020916 3beta-Acetoxy-1(5),11(13)-guaiadien-12,8alpha-olide 90.91
C00020917 3beta-Acetoxy-5,11(13)-guaiadien-12,8alpha-olide 90.91
C00020997 [3aR-(3aalpha,4aalpha,6beta,7aalpha,9abeta)]-6-(Acetyloxy)decahydro-3,5,8-tris(methylene)-azuleno[6,5-b]furan-2(3H)-one 90.91
C00021018 3beta-Acetoxy-desoxo-achalensolide 90.91
C00021695 Acetylivalin 90.91
C00022675 14-Acetoxy-11alpha,13-dihydrodesoxyivangustin 90.91
C00032545 Zaluzanin D 90.91
C00003314 Laurenobiolide 90.70
C00011774 [3S-(3R*,3aS*,4R*,7S*,10E,11aS*)]-3a,4,5,6,7,8,9,11a-octahydro-7-hydroperoxy-4-hydroxy-3,10-dimethyl-6-methylene-Cyclodeca[b]furan-2(3H)-one 90.70
C00012070 Shiromodiol monoacetate 90.70
C00012838 9beta-Acetoxy-4,5-dehydro-4(15)-dihydrocostic acid
[2S-(2alpha,4alpha,4aalpha)]-4-(acetyloxy)-1,2,3,4,4a,5,6,7-Octahydro-4a,8-dimethyl-alpha-methylene-2-naphthaleneacetic acid		 90.70
C00021108 4beta-Acetoxy-4-desoxodamsinic acid 90.70
C00022656 3alpha-Hydroxy-8alpha-acetoxy-3-desoxo-11beta,13-dihydroparishin A 89.58
C00003392 Viscidulin B 89.36
C00003217 Arnicolide A 89.13
C00003288 Gaillardin 89.13
C00003319 Lipiferolide 89.13
C00012102 Lanuginolide 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
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
C00020476 Achillicin 89.13
C00020478 Cumambrin A 89.13
C00020480 Dihydrocumambrin A 89.13
C00020510 8alpha-Acetoxyzaluzanin C 89.13
C00020515 Kandavanolide
8beta-Hydroxyzaluzanin D		 89.13
C00020539 Jurmolide 89.13
C00033757 Dehydrolanuginolide 89.13
C00034392 3-Oxa-achillicin
8-Acetylegeloide		 89.13
C00034766 CID is old! 89.13
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