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


and

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




INPUT WORD = C00012246 , 50% or more
[ Metabolite Name : [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 ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012248 [7R-(7R*,9S*,10E,11aR*)]- 9-(Acetyloxy)-5,6,7,8,9,11a-hexahydro-7-hydroxy-3-(hydroxymethyl)-10-methyl-6-methylenecyclodeca[b]furan-2(4H)-one,
13-Desacetyl-1alpha-hydroxyafraglaucolide		 97.87
C00012252 [9S-(9R*,10E,11aS*)]-9-(acetyloxy)-5,6,9,11a-tetrahydro-3-(hydroxymethyl)-10-methyl-6-methylenecyclodeca[b]furan-2,7(4H,8H)-dione 95.74
C00012255 Achillolide A 95.74
C00013088 [5aR-(5aalpha,6alpha,8alpha,9abeta,9balpha)]-8-(Acetyloxy)-5,5a,6,7,8,9,9a,9b-octahydro-6-hydroxy-3-(hydroxymethyl)-5a-methyl-9-methylenenaphtho[1,2-b]furan-2(4H)-one 91.67
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		 91.49
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		 91.49
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		 91.49
C00020895 Calocephalin acetate 91.49
C00022640 2alpha-Acetoxyeupatolide 91.49
C00003374 Tetraneurin E 89.58
C00040198 Salograviolide A 89.58
C00000132 3-Acetoxy-13-hydroxy-1(10),4,7(11)-germacratrien-12,6-olide 89.36
C00003269 Eupaformonin 89.36
C00003288 Gaillardin 89.36
C00003357 Pyrethrosin 89.36
C00003395 Xanthumin 89.36
C00011755 Herbolide D 89.36
C00012199 Herbolide B 89.36
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		 89.36
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		 89.36
C00020337 Isoxanthanol
4-Acetylivalbin		 89.36
C00020515 Kandavanolide
8beta-Hydroxyzaluzanin D		 89.36
C00021044 Apachin 89.36
C00013084 [5aR-(5aalpha,6alpha,8alpha,9beta,9abeta,9balpha)]-8-(Acetyloxy)-5,5a,6,7,8,9,9a,9b-octahydro-6,9-dihydroxy-3-(hydroxymethyl)-5a,9-dimethylnaphtho[1,2-b]furan-2(4H)-one 88.00
C00003380 epi-Tulipinolide diepoxide 87.76
C00012083 (-)-Blumealactone C
Blumealactone C		 87.50
C00012883 [3aR-(3aalpha,6alpha,8abeta,9aalpha)]-5-[(Acetyloxy)methyl]-3a,4,6,7,8,8a,9,9a-octahydro-6-hydroperoxy-8a-methyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one 87.50
C00020860 9beta-Hydroxykandavanolide 87.50
C00020995 2-Deoxy-14-acetoxypleniradin 87.50
C00021158 15-Desacetyltetraneurin C 87.50
C00021159 Tetraneurin D 87.50
C00022656 3alpha-Hydroxy-8alpha-acetoxy-3-desoxo-11beta,13-dihydroparishin A 87.50
C00033647 Anthemolide C 87.50
C00000313 Xanthinin 87.23
C00003343 Ovatifolin 87.23
C00011783 Chihuahuin 87.23
C00011826 [3aS-(3aR*,6Z,10Z,11aS*)]-10-[(Acetyloxy)methyl]-3a,4,5,8,9,11a-hexahydro-6-(hydroxymethyl)-3-methylenecyclodeca[b]furan-2(3H)-one 87.23
C00011827 Perymeniolide 87.23
C00012059 Dicotomentolide 87.23
C00012185 Novanin 87.23
C00012329 Tulirinol 87.23
C00012333 Chrysanolide
Tamirin acetate		 87.23
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		 87.23
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		 87.23
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 87.23
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		 87.23
C00020510 8alpha-Acetoxyzaluzanin C 87.23
C00020622 [3aS-(3aalpha,7alpha,7abeta,8abeta,8balpha,8cbeta)]-7-(Acetyloxy)-3a,4,5,7,7a,8a,8b,8c-octahydro-6,8a-dimethyl-3-methylene-oxireno[2,3]azuleno[4,5-b]furan-2(3H)-one 87.23
C00020882 Inuchinenolide B 87.23
C00020884 Puberolide 87.23
C00020887 Neogaillardin
Pleniradin acetate		 87.23
C00022683 Ivangustin acatate 87.23
C00030486 Hiyodorilactone C 87.23
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