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


and

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





INPUT WORD = C00012924 , 50% or more
[ Metabolite Name : [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 ]
Number of matched data : 56

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00021695 Acetylivalin 95.45
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 93.18
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
93.18
C00021023 15-Acetoxy-11beta,13-dihydroziniolide 93.18
C00012972 Isoludalbin
[3aR-(3aalpha,4alpha,5abeta,6alpha,9aalpha,9bbeta)]-6-(acetyloxy)-3a,4,5,5a,6,7,9a,9b-Octahydro-4-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
91.30
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
91.30
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
91.30
C00012221 Argentiolide B 91.11
C00012390 Calbertolide A 91.11
C00003379 epi-Tulipinolide 90.91
C00012037 Epitulipdienolide
Elemanolide
90.91
C00012198 Herbolide A 90.91
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 90.91
C00012699 [4aR-(4aalpha,5alpha,6beta,8abeta)]-5-(Acetyloxy)-4a,5,6,7,8,8a-hexahydro-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-2(1H)-naphthalenone 90.91
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
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
90.91
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
90.91
C00020786 Zuurbergenin 90.91
C00022675 14-Acetoxy-11alpha,13-dihydrodesoxyivangustin 90.91
C00022683 Ivangustin acatate 90.91
C00030613 Kikkanol D monoacetate
(-)-Kikkanol D monoacetate
90.91
C00030616 Kikkanol F monoacetate
(-)-Kikkanol F monoacetate
90.91
C00032545 Zaluzanin D 90.91
C00039354 Hedyosumin D
(+)-Hedyosumin D
90.91
C00046475 Tubipolide A
(-)-Tubipolide A
90.91
C00049504 Oidiolactone F
(-)-Oidiolactone F
90.91
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
89.58
C00003319 Lipiferolide 89.13
C00012102 Lanuginolide 89.13
C00012108 9alpha-Acetoxyparthenolide 89.13
C00012200 Herbolide C 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
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
89.13
C00012870 [4aS-(4aalpha,8beta,8abeta,9abeta)]-8-(Acetyloxy)-4a,7,8,8a,9,9a-hexahydro-9a-hydroxy-3,5,8a-trimethyl-naphtho[2,3-b]furan-2(4H)-one 89.13
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
89.13
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
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
C00020471 4-epi-Matricin
4-Epimatricin
89.13
C00033757 Dehydrolanuginolide 89.13
C00046477 Tubipolide C
(-)-Tubipolide C
89.13
C00003343 Ovatifolin 88.89
C00011757 (+)-Heliangolidin
Heliangolidin
88.89
C00020337 Isoxanthanol
4-Acetylivalbin
88.89
C00021700 9beta-Propionyloxy costunolide 88.89
C00030486 Hiyodorilactone C 88.89
C00003378 Tulipinolide 88.64
C00012070 Shiromodiol monoacetate 88.64
C00012185 Novanin 88.64
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
88.64
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
88.64
C00020293 Bemarivolide 88.64
C00020730 Penziafulvenolide 88.64
C00021108 4beta-Acetoxy-4-desoxodamsinic acid 88.64
C00023378 Acrostalidic acid 88.64
C00041308 Acetyl neobritannilactone B 88.64
C00041808 Russujaponol B
(-)-Russujaponol B
88.64
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