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


and

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




INPUT WORD = C00021700 , 50% or more
[ Metabolite Name : 9beta-Propionyloxy costunolide ]
Number of matched data : 57

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012198 Herbolide A 95.56
C00003379 epi-Tulipinolide 93.33
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		 93.33
C00021023 15-Acetoxy-11beta,13-dihydroziniolide 93.33
C00021701 9beta-(2-Methyl butyryloxy)-costunolide 91.84
C00021702 9beta-Isovaleryloxy costunolide 91.84
C00012108 9alpha-Acetoxyparthenolide 91.30
C00012199 Herbolide B 91.30
C00012200 Herbolide C 91.30
C00003343 Ovatifolin 91.11
C00003378 Tulipinolide 91.11
C00011755 Herbolide D 91.11
C00011757 (+)-Heliangolidin
Heliangolidin		 91.11
C00012185 Novanin 91.11
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		 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
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
C00021695 Acetylivalin 91.11
C00030486 Hiyodorilactone C 91.11
C00041308 Acetyl neobritannilactone B 91.11
C00042722 Mayolide A 89.58
C00003319 Lipiferolide 89.13
C00012102 Lanuginolide 89.13
C00033757 Dehydrolanuginolide 89.13
C00003269 Eupaformonin 88.89
C00011783 Chihuahuin 88.89
C00012221 Argentiolide B 88.89
C00012924 [3aR-(3aalpha,4aalpha,8abeta,9aalpha)]- 5-[(Acetyloxy)methyl]-3a,4,4a,7,8,8a,9,9a-octahydro-8a-methyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one
15-Acetoxyisoalloalantolactone		 88.89
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		 88.89
C00020884 Puberolide 88.89
C00032545 Zaluzanin D 88.89
C00045609 Acalycixeniolide L
(+)-Acalycixeniolide L		 88.89
C00049067 12,14-Dihydroxyphytol
(-)-12,14-Dihydroxyphytol		 88.89
C00011852 Acantholide 88.24
C00012261 Leucanthanolide 88.24
C00012174 Hallerin 87.76
C00012214 Glabratolide 87.76
C00021686 Salonitenolide 8-O-angelate 87.76
C00047064 Lobohedleolide
(+)-Lobohedleolide		 87.76
C00012910 Subcordatolide E
[3aR-(3aalpha,4aalpha,8beta,8abeta,9abeta)]-2,3,3a,4,4a,7,8,8a,9,9a-Decahydro-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-8-yl ester 2-methylpropanoic acid		 87.50
C00041459 Crassocolide E
(+)-Crassocolide E		 87.50
C00042883 Pulicanadiene C
(-)-Pulicanadiene C		 87.50
C00012849 Decahydro-alpha,4a-dimethyl-8-methylene-7-(2-methyl-1-oxopropoxy)-2-naphthaleneacetic acid 87.23
C00020625 2beta-Acetoxy-3alpha,4alpha-epoxy-3,4-dihydrokauniolide 87.23
C00020741 2-Acetylzafronic acid 87.23
C00020747 [1R-(1alpha,4alpha,4aalpha,6alpha,8aalpha)]-6-(Acetyloxy)-1,2,3,4,4a,5,6,8a-octahydro-4-hydroxy-4,7-dimethyl-a-methylene-1-naphthaleneacetic acid methyl ester 87.23
C00041845 Sarcophytonolide F
(+)-Sarcophytonolide F		 87.23
C00003217 Arnicolide A 86.96
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		 86.96
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 86.96
C00020472 Michefuscalide
beta-Cyclolipiferolide		 86.96
C00020515 Kandavanolide
8beta-Hydroxyzaluzanin D		 86.96
C00020522 Athamontanolide 86.96
C00020887 Neogaillardin
Pleniradin acetate		 86.96
C00021090 Ergolide
Dihydrobigelovin		 86.96
C00021096 Rudmollitrin 86.96
C00021680 Naviculide 86.96
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