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


and

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




INPUT WORD = C00013209 , 50% or more
[ Metabolite Name : Isosmyrnicordiolide , 4a,9a,10,10a-Tetrahydro-3,5,9a-trimethylfuro[2,3-h][3]benzoxepin-2(4H)-one ]
Number of matched data : 77

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00013206 Smyrnicordiolide
[4aR-(4aalpha,9abeta,10abeta)]-4a,9a,10,10a-Tetrahydro-3,5,9a-trimethylfuro[2,3-h][3]benzoxepin-2(4H)-one		 94.74
C00013208 Smyrnicordi-8-enolide
(4aR-trans)-4a,9a-Dihydro-3,5,9a-trimethylfuro[2,3-h][3]benzoxepin-2(4H)-one		 94.74
C00012932 [3aR-(3aalpha,4aalpha,6beta,8abeta,9aalpha)]-3a,4,4a,5,6,8a,9,9a-Octahydro-6-hydroxy-8a-methyl-3,5-bis(methylene)naphtho[2,3-b]furan-2(3H)-one 92.11
C00012943 [3aR-(3aalpha,4aalpha,5beta,8abeta,9aalpha)]-3a,4a,5,8a,9,9a-Hexahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2,6(3H,4H)-dione 92.11
C00012944 Virginin
[3S-(3alpha,3abeta,4abeta,8aalpha,9abeta)]-3a,4a,5,8a,9,9a-Hexahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2,6(3H,4H)-dione		 92.11
C00021102 2alpha-Hydroxy-eudesm-3,11(13)-dien-12,8beta-olide 92.11
C00046476 Tubipolide B
(-)-Tubipolide B		 92.11
C00046479 Tubipolide F
(-)-Tubipolide F		 92.11
C00013207 Tubipolide E
[4aR-(4aalpha,9abeta,10abeta)]-4a,9a,10,10a-Tetrahydro-10a-hydroxy-3,5,9a-trimethylfuro[2,3-h][3]benzoxepin-2(4H)-one		 90.00
C00012876 Ursialpinolide
[1aR-(1aalpha,3aalpha,4abeta,7abeta,8abeta,8balpha)]-1a,4,4a,7,7a,8,8a,8b-Octahydro-3a,8b-dimethyl-7-methyleneoxireno[5,6]naphtho[2,3-b]furan-6(3aH)-one		 89.74
C00003254 Encelin 89.47
C00003310 Ivalin
[3aR-(3aalpha,4aalpha,7alpha,8abeta,9aalpha)]-Decahydro-7-hydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one		 89.47
C00012021 15-Hydroxyelemasteriactinolide 89.47
C00012036 Hydroxyisogermafurenolide 89.47
C00012051 Spirafolide 89.47
C00012897 Lindestrenolide
[4aS-(4aalpha,8abeta,9abeta)]-4a,5,6,8a,9,9a-Hexahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 89.47
C00012912 Pinnatifidin (Helenium)
[3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-3,3a,4,4a,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenepinnatifidin
Naphtho[2,3-b]furan-2,7-dione		 89.47
C00012913 (+)-Isotelekin
Isotelekin		 89.47
C00012920 [3aS-(3aalpha,4aalpha,8abeta,9aalpha)]- 3a,4,4a,7,8,8a,9,9a-Octahydro-4a-hydroxy-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one
ent-7alpha-Hydroxydipophyllolide		 89.47
C00012921 8beta-Hydroxyasterolide
Atractylenolide III
Codonolactone
[4aS-(4aalpha,8abeta,9abeta)]-4a,5,6,7,8,8a,9,9a-Octahydro-9a-hydroxy-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 89.47
C00012941 [3aS-(3aalpha,8abeta,9aalpha)]-3a,7,8,8a,9,9a-Hexahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2,6(3H,4H)-dione
3-Oxodiplophyllin		 89.47
C00012942 (-)-Yomogin
[3aR-(3aalpha,8abeta,9aalpha)]-3a,8a,9,9a-Tetrahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2,6(3H,4H)-dione		 89.47
C00012946 [4aS-(4aalpha,5alpha,8abeta,9abeta)]-4a,6,7,8a,9,9a-Hexahydro-3,5,8a-trimethylnaphtho[2,3-b]furan-2,8(4H,5H)-dione 89.47
C00020097 Heritol 89.47
C00021698 8-epi-Isovangustin 89.47
C00032152 Sinodielide C
(-)-Sinodielide C		 89.47
C00038337 9alpha-Hydroxyasterolide 89.47
C00044955 Neolitacumone B
(+)-Neolitacumone B		 89.47
C00012050 Deoxysericealactone 87.80
C00003283 Farinosin 87.50
C00045555 3,4-Epoxy-7,11-dehydro-13-hydroxymethylelemen-12,8-olide 87.50
C00011466 [R-(E)]-5-[5-(2,5-Dihydro-5-oxo-3-furanyl)-2-methyl-2-pentenyl]-3-methyl-2(5H)-furanone 87.18
C00011775 2alpha-Hydroxyeupatolide 87.18
C00012039 Isosericenin 87.18
C00012211 [10S-(6E,10R*,11aS*)]-5,8,11,11a-Tetrahydro-3-(hydroxymethyl)-6,10-dimethylcyclodeca[b]furan-2,9(4H,10H)-dione 87.18
C00013580 Chloranthalactone D
4a,5,5a,6,6a,6b,7,7a-Octahydro-7a-hydroxy-3,6b-dimethyl-5-methylenecycloprop[2,3]indeno[5,6-b]furan-2(4H)-one		 87.18
C00003345 Parthenolide 86.84
C00003364 Santonin
Semenen
(-)-alpha-Santonin
(-)-Santonin
a-Santonin
[3S-(3alpha,3aalpha,5abeta,9bbeta)]-3a,5,5a,9b-Tetrahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 86.84
C00003365 beta-Santonin
[3R-(3alpha,3abeta,5aalpha,9balpha)]-3a,5,5a,9b-Tetrahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 86.84
C00003396 Xeratholide 86.84
C00011468 Freelingnite
(+)-5-[5-(3-Furanyl)-2-methyl-2-pentenyl]-3-methyl-2(5H)-furanone		 86.84
C00012019 Isogermafurenolide 86.84
C00012022 [3R-(3alpha,3aalpha,5alpha,6beta,7aalpha)]-6-Ethenylhexahydro-5-[1-(hydroxymethyl)ethenyl]-3,6-dimethyl-(3H)-benzofuranone 86.84
C00012038 Isofischeric acid 86.84
C00012041 Isolinderalactone 86.84
C00012043 Dihydroepiisolinderalactone 86.84
C00012182 [3aS-(3aR*,6Z,8R*,10Z,11aS*)]-3a,4,5,8,9,11a-Hexahydro-8-hydroxy-6,10-dimethyl-3-methylenecyclodeca[b]furan-2(3H)-one 86.84
C00012725 Viscosic acid 86.84
C00012833 2-Hydroxyisocostic acid 86.84
C00012834 [2R-(2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-alpha-methylene-6-oxo-2-naphthaleneacetic acid 86.84
C00012844 [2R-(2alpha,4aalpha,8abeta)]-1,2,3,4,4a,7,8,8a-Octahydro-4a-methyl-alpha,8-bis(methylene)-7-oxo-2-naphthaleneacetic acid 86.84
C00012887 Asterolide
Atractylenolide II
[4aS-(4aalpha,8abeta,9abeta)]-4a,5,6,7,8,8a,9,9a-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 86.84
C00012888 8-Epiasterolide
[4aS-(4aalpha,8abeta,9aalpha)]-4a,5,6,7,8,8a,9,9a-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 86.84
C00012899 [3aR-(3aalpha,4abeta,8aalpha,9aalpha)]-3a,4,4a,5,6,8a,9,9a-Octahydro-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one
1,2,4,15-Tetrahydro-4,5-dihydrosteiractinolide		 86.84
C00012903 3alpha-Hydroxyfuroepaltol
[4aR-(4aalpha,5alpha,6alpha,8abeta)]-4,4a,5,6,7,8,8a,9-Octahydro-3,5,8a-trimethylnaphtho[2,3-b]furan-5,6-diol		 86.84
C00012914 Septuplinolide
[3aR-(3aalpha,4aalpha,5beta,8abeta,9aalpha)]-Decahydro-5-hydroxy-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 86.84
C00012927 Inunal
[3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-2,3,3a,4,4a,7,8,8a,9,9a-Decahydro-8a-methyl-3-methylene-2-oxonaphtho[2,3-b]furan-5-carboxaldehyde		 86.84
C00012931 [3R-(3alpha,3aalpha,4aalpha,5beta,6alpha,8abeta,9aalpha)]-Decahydro-6-hydroxy-3,5,8a-trimethylnaphtho[2,3-b]furan-2(3H)-one
3-Hydroxy-12,8-eudesmanolide		 86.84
C00013050 Brachylaenolide
[3aS-(3aalpha,5abeta,8alpha,9aalpha,9bbeta)]-3a,4,5,5a,8,9,9a,9b-Octahydro-8-hydroxy-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one		 86.84
C00013051 Dehydrobrachylaenolide
[3aS-(3aalpha,5abeta,9aalpha,9bbeta)]-3a,5,5a,9,9a,9b-Hexahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2,8(3H,4H)-dione		 86.84
C00013077 Alloisosantonin
[3S-(3alpha,3aalpha,5abeta,9aalpha,9bbeta)]-3a,5,5a,9,9a,9b-hexahydro-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2,8(3H,4H)-dione		 86.84
C00017329 3beta-Hydroxyxanthanodiene
[3aR-(3aalpha,4abeta,5beta,6beta,9aalpha)]-3a,4,4a,5,6,7,9,9a-octahydro-6-hydroxy-4a,5-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one		 86.84
C00017330 3-Oxoxanthanodiene
[3aR-(3aalpha,4abeta,5beta,9aalpha)]-3a,4a,5,7,9,9a-Hexahydro-4a,5-dimethyl-3-methylene-naphtho[2,3-b]furan-2,6(3H,4H)-dione		 86.84
C00017397 10alpha-Hydroxyeremophila-1,11(13)-dien-12,8beta-olide 86.84
C00017438 Istanbulin C 86.84
C00017439 2-Oxo-eremophila-1(10),11(13)-dien-12,8beta-olide 86.84
C00017440 Istanbulin B 86.84
C00020230 2-Oxoverboccidentafuran 86.84
C00020721 Tannunolide E 86.84
C00020782 8-Deoxyrupicolin B
1alpha-Hydroxy-3,10(14),11(13)-guaiatrien-12,6alpha-olide		 86.84
C00020950 Achalensolide
8-Epixerantholide		 86.84
C00021138 8-epi-Confertin 86.84
C00021143 Aromatin 86.84
C00029605 8-Hydroxylindestenolide 86.84
C00034300 Taraxacin
(-)-Taraxacin		 86.84
C00045553 3,4-Epoxy-11alpha,13-dihydroelemen-12,8-olide
(+)-3,4-Epoxy-11alpha,13-dihydroelemen-12,8-olide		 86.84
C00045554 3,4-Epoxy-5,10-epi-elemasteriractinolide 86.84
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