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


and

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




INPUT WORD = C00012889 , 50% or more
[ Metabolite Name : Atractylenolide I , (4aS-trans)- 4a,5,6,7,8,8a-hexahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one ]
Number of matched data : 72

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012949 (-)-Shizukafuranol
Shizukafuranol
[4aR-(4aalpha,5alpha,8abeta)]-4,4a,5,6,7,8,8a,9-Octahydro-3,5,8a-trimethylnaphtho[2,3-b]furan-5-ol		 97.22
C00012915 (-)-Shizukolidol
Shizukolidol
[4aR-(4aalpha,5alpha,8abeta)]-4a,5,6,7,8,8a-Hexahydro-5-hydroxy-3,5,8a-trimethylnaphtho[2,3-b]furan-2(4H)-one		 94.74
C00020779 5alpha-Hydroxy-eudesma-4(15),7(11),8(9)-trien-8,12-olide 94.74
C00044956 Neolitacumone C
(+)-Neolitacumone C		 94.74
C00016962 Shizukanolide B
Chloranthalactone A		 94.59
C00011970 (+)-Aoifuranone
Aoifuranone		 94.44
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		 94.44
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		 94.44
C00012898 Dehydrolindestrenolide
(4aS-trans)-4a,5,6,8a-Tetrahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 94.44
C00017372 Ligularone 94.44
C00017374 Furoeremophilone 1 94.44
C00017376 8,12-Epoxy-10alpha-Eremophila-7,11-dien-9-one 94.44
C00020299 Bemadienolide 94.44
C00040292 Shizukanolide C 92.31
C00013584 Lindenenol
(4R,4aS,5aS,6aR,6bS)-4,4a,5,5a,6,6a,6b,7-Octahydro-3,6b-dimethyl-5-methylenecycloprop[2,3]indeno[5,6-b]furan-4-ol
Linderene		 91.89
C00003236 Confertifolin 91.67
C00003259 Eremophilenolide
Eremophylenolide		 91.67
C00011570 (+)-Pallescensone
Pallescensone		 91.67
C00012019 Isogermafurenolide 91.67
C00012040 Curzerene
Isogermafuren
Isogermafurene
Neocurzerene		 91.67
C00012937 Atractylol
Atractylon
Atractyloxide
4,4aalpha,5,6,7,8,8a,9-Octahydro-3,8alphabeta-dimethyl-5-methylenenaphtho[2,3-b]furan		 91.67
C00013583 (-)-Lindenene
(4aS,5aS,6aR,6bS)-4,4a,5,5a,6,6a,6b,7-Octahydro-3,6b-dimethyl-5-methylenecycloprop[2,3]indeno[5,6-b]furan		 91.67
C00017336 Tetrahydroligularenolide 91.67
C00017375 (4aR-cis)-4a,5,6,7-Tetrahydro-3,4a,5-trimethyl-naphtho[2,3-b]furan-8(4H)-one 91.67
C00016964 Onoseriolide
13-Hydroxy-8,9-dehydroshizukanolide		 89.74
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		 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
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
C00017349 Furanofukinol 89.47
C00017357 Tetradymodiol 89.47
C00017371 6beta-Methoxyfuranoeremophilane
Furanofukinin
Petasalbin methyl ether		 89.47
C00017410 Euryopsonol 89.47
C00038337 9alpha-Hydroxyasterolide 89.47
C00044955 Neolitacumone B
(+)-Neolitacumone B		 89.47
C00046479 Tubipolide F
(-)-Tubipolide F		 89.47
C00048583 1-epimenverin B
(-)-1-epimenverin B		 89.47
C00012036 Hydroxyisogermafurenolide 89.19
C00012038 Isofischeric acid 89.19
C00013585 Lindenenone
(5aS,6aR,6bS)-6,6a,6b,7-Tetrahydro-3,5,6b-trimethylcycloprop[2,3]indeno[5,6-b]furan-4(5aH)-one		 89.19
C00017317 [1aR-(1aalpha,4beta,4abeta,9aS*)]-1a,2,4,4a,5,9-Hexahydro-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan 89.19
C00017318 [1aS-(1aalpha,4alpha,4aalpha,9aS*)]-1a,2,4,4a,5,9-Hexahydro-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan 89.19
C00003193 Tetradymol 88.89
C00003306 Isoalantolactone
Isoallantolactone
Isohelenin		 88.89
C00011504 Vernopolyanthofuran 88.89
C00011544 Ancistrodial 88.89
C00011567 Dihydropallescensin 2
Penlanpallescensin		 88.89
C00011972 Curzerenone 88.89
C00012023 [3aR-(3aalpha,5beta,6alpha,7aalpha)]-6-Ethenylhexahydro-6-methyl-3-methylene-5-(1-methylethenyl)-2(3H)-benzofuranone 88.89
C00012024 Igalan
Elemasteriactinolide		 88.89
C00012354 Furanocaulesone A 88.89
C00012358 Furanogermenone 88.89
C00012540 [1S-(1alpha,2beta,5alpha)]-2-(1,2-Dimethylbicyclo[3.1.0]hex-2-yl)-5-methyl-2,5-cyclohexadiene-1,4-dione
(-)-Laurequinone
Laurequinone		 88.89
C00012878 [3R-(3alpha,3aalpha,4abeta,8aalpha,9aalpha)]-Decahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one
Dihydroallitrisin		 88.89
C00012890 Isoasterolide A
[3R-(3alpha,4aalpha,8abeta)]-4,4a,5,6,7,8,8a,9-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one		 88.89
C00012891 Isoasterolide B
[3S-(3alpha,4abeta,8aalpha)]-4,4a,5,6,7,8,8a,9-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one		 88.89
C00012892 Neoalantolactone 88.89
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		 88.89
C00012936 Lindestrene
(4aS-trans)-4,4a,5,6,8a,9-Hexahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan		 88.89
C00013033 Critonilide
[3aR-(3aalpha,5aalpha,9abeta,9balpha)]-Decahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one		 88.89
C00013034 (+)-beta-Frullanolide
[3aR-(3aalpha,5abeta,9aalpha,9balpha)]-Decahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one		 88.89
C00017334 (-)-Ligularenolide
Ligularenolid
Ligularenolide		 88.89
C00017339 9,10-Dehydrofuranoeremophilane 88.89
C00017368 Petasalbin
Ligularol
6-Hydroxyfuranoeremophilane		 88.89
C00017394 10alpha-Furanoligularenone 88.89
C00017395 9-Oxoeuryopsin
Furanoeremophil-1(10)-en-9-one		 88.89
C00020085 (+)-Curzeone 88.89
C00020165 1beta-Hydroxyverboccidentafuran 88.89
C00020304 Isodrimenin 88.89
C00020330 4(13),8-Coloratadienolide 88.89
C00021013 5,10-bis-epi-Isoalantolactone 88.89
C00021716 Spiroeuryolide 88.89
C00046476 Tubipolide B
(-)-Tubipolide B		 88.89
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