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


and

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





INPUT WORD = C00012387 , 50% or more
[ Metabolite Name : [3aR-(3aR*,5Z,9E,11aS*)]-6-[(Acetyloxy)methyl]-3a,4,7,8,11,11a-hexahydro-10-methyl-3-methylenecyclodeca[b]furan-2(3H)-one ]
Number of matched data : 58

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
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
95.45
C00012390 Calbertolide A 93.33
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
93.18
C00032545 Zaluzanin D 93.18
C00003314 Laurenobiolide 93.02
C00012037 Epitulipdienolide
Elemanolide
93.02
C00041308 Acetyl neobritannilactone B 93.02
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 91.30
C00020478 Cumambrin A 91.30
C00020480 Dihydrocumambrin A 91.30
C00003343 Ovatifolin 91.11
C00011818 15-Acetoxy-8alpha-hydroxycostunolide 91.11
C00012335 Soulangianolide B 91.11
C00041255 1-O-Acetylbritannilactone
Britannilactone 1-O-acetate
91.11
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
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
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
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
90.91
C00020730 Penziafulvenolide 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
C00021023 15-Acetoxy-11beta,13-dihydroziniolide 90.91
C00021695 Acetylivalin 90.91
C00022675 14-Acetoxy-11alpha,13-dihydrodesoxyivangustin 90.91
C00032264 Sulfocostunolide A 90.91
C00032265 Sulfocostunolide B 90.91
C00041307 Acetoxyanthecotulide
(+)-Acetoxyanthecotulide
90.91
C00046475 Tubipolide A
(-)-Tubipolide A
90.91
C00003367 Scorpioidin 90.70
C00003379 epi-Tulipinolide 90.70
C00011382 9-Oxo-5-acetoxynerolidol 90.70
C00012198 Herbolide A 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
C00020402 Watsonol B 90.70
C00021108 4beta-Acetoxy-4-desoxodamsinic acid 90.70
C00030613 Kikkanol D monoacetate
(-)-Kikkanol D monoacetate
90.70
C00030616 Kikkanol F monoacetate
(-)-Kikkanol F monoacetate
90.70
C00039299 Guai-6-ene 90.70
C00020620 8alpha-Acetoxy-1beta,10beta-epoxy-3,11(13)-guaiadien-12,6alpha-olide 89.36
C00020691 Viscidulin A 89.36
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
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
89.13
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
89.13
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
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
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
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
C00020472 Michefuscalide
beta-Cyclolipiferolide
89.13
C00020805 Montanone
Montanone(terpene)
89.13
C00020816 11,12-Dehydromatricarin
Dehydromatricarin A
(+)-Dehydromatricarin A
89.13
C00020930 6alpha-Acetoxy-4alpha-hydroxy-9,11(13)-guaiadien-12,8alpha-olide 89.13
C00021095 15-Acetoxyrudmollin 89.13
C00021096 Rudmollitrin 89.13
C00035781 15-O-Acetylamphoricarpolide 89.13
C00046477 Tubipolide C
(-)-Tubipolide C
89.13
Page Top