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


and

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




INPUT WORD = C00012047 , 50% or more
[ Metabolite Name : [3aR-(3aalpha,3bbeta,7aalpha,8aalpha,8bbeta,8cbeta,9abeta)]-3a,3b,7a,8a,8b,8c,9,9a-Octahydro-8b-methyl-3-methylene-5H-difuro[4,3,2-ef:3',2'-h]oxireno[a][3]benzoxepin-2,5(3H)-dione , 1beta,2beta-Epoxymiscandenin ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00003251 Dihydromikanolide 93.48
C00003332 Mikanolide 93.48
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
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
C00012328 Mikaperiplocolide 89.13
C00012333 Chrysanolide
Tamirin acetate		 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
C00012938 Mikacynancholide
[3aR-(3aalpha,3bbeta,6aalpha,7aalpha,7bbeta,7cbeta,8abeta)]-3a,3b,6a,7a,7b,7c,8,8a-Octahydro-7b-methyl-3-methylene-2H-oxireno[5,6]naphtho[3,2-b:1,8-b'c']difuran-2,5(3H)-dione		 89.13
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		 89.13
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		 89.13
C00020434 Andalucin 89.13
C00021095 15-Acetoxyrudmollin 89.13
C00020691 Viscidulin A 87.23
C00003217 Arnicolide A 86.96
C00003319 Lipiferolide 86.96
C00003350 Picrotoxinin 86.96
C00012033 Zinniadilactone 86.96
C00012046 Miscandenin 86.96
C00012102 Lanuginolide 86.96
C00012221 Argentiolide B 86.96
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		 86.96
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		 86.96
C00012973 Ludalbin
[3aR-(3aalpha,4alpha,5abeta,6alpha,9aalpha,9bbeta)]-4-(acetyloxy)-3a,4,5,5a,6,7,9a,9b-Octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 86.96
C00012975 alpha-Liriodenolide
[3aR-(3aalpha,4beta,5abeta,6beta,9aalpha,9bbeta)]-4-(acetyloxy)-3a,4,5,5a,6,7,9a,9b-octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 86.96
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		 86.96
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		 86.96
C00020337 Isoxanthanol
4-Acetylivalbin		 86.96
C00020450 Rupin A 86.96
C00020478 Cumambrin A 86.96
C00020480 Dihydrocumambrin A 86.96
C00020930 6alpha-Acetoxy-4alpha-hydroxy-9,11(13)-guaiadien-12,8alpha-olide 86.96
C00021069 6-Deoxychamissonolide 86.96
C00021071 Stevin 86.96
C00021359 Aduncin 86.96
C00021363 Coriatin 86.96
C00021364 Corianin 86.96
C00033119 Lindenanolide H 86.96
C00033757 Dehydrolanuginolide 86.96
C00034392 3-Oxa-achillicin
8-Acetylegeloide		 86.96
C00034766 CID is old! 86.96
C00040929 Crithmifolide 86.96
C00043182 3alpha-Hydroxy-11beta,13-dihydrodeoxymikanolide 86.96
C00020599 Artefransin 85.71
C00021098 Gaillardilin 85.71
C00021176 Flexuosin A 85.42
C00022657 8alpha-Acetoxy-11beta,13-dihydroparishin A 85.42
C00003392 Viscidulin B 85.11
C00012059 Dicotomentolide 85.11
C00020896 Maxicanin G 85.11
C00046436 Strychnistenolide acetate 85.11
Page Top