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


and

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




INPUT WORD = C00017334 , 50% or more
[ Metabolite Name : (-)-Ligularenolide , Ligularenolid , Ligularenolide ]
Number of matched data : 66

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00017395 9-Oxoeuryopsin
Furanoeremophil-1(10)-en-9-one		 94.44
C00017375 (4aR-cis)-4a,5,6,7-Tetrahydro-3,4a,5-trimethyl-naphtho[2,3-b]furan-8(4H)-one 91.67
C00017422 [4S-(4alpha,4aalpha,5alpha)]-4a,5,6,7-Tetrahydro-4-hydroxy-3,4a,5-trimethylnaphtho[2,3-b]furan-9(4H)-one 89.47
C00012889 Atractylenolide I
(4aS-trans)- 4a,5,6,7,8,8a-hexahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 88.89
C00012898 Dehydrolindestrenolide
(4aS-trans)-4a,5,6,8a-Tetrahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 88.89
C00017327 Xanthanodiene
[3aR-(3aalpha,4abeta,5beta,9aalpha)]-3a,4,4a,5,6,7,9,9a-octahydro-4a,5-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one		 88.89
C00017339 9,10-Dehydrofuranoeremophilane 88.89
C00017368 Petasalbin
Ligularol
6-Hydroxyfuranoeremophilane		 88.89
C00017372 Ligularone 88.89
C00017374 Furoeremophilone 1 88.89
C00017376 8,12-Epoxy-10alpha-Eremophila-7,11-dien-9-one 88.89
C00017394 10alpha-Furanoligularenone 88.89
C00020085 (+)-Curzeone 88.89
C00017389 2,9-Dioxoeuryopsin 86.84
C00017434 6beta-Hydroxy-9,10-didehydrofuranoeremophilan-1-one 86.84
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 86.49
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 86.49
C00003193 Tetradymol 86.11
C00003259 Eremophilenolide
Eremophylenolide		 86.11
C00011581 Microcionin 2 86.11
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		 86.11
C00016979 Isovalencenic acid 86.11
C00016995 Warburgiadione
Eremophila-1,7(11),9-triene-3,8-dione		 86.11
C00017336 Tetrahydroligularenolide 86.11
C00021012 [3aR-(3aalpha,4abeta,5beta,9aalpha)]-3a,4,4a,5,6,7,8,9a-Octahydro-4a,5-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one 86.11
C00021714 (4S,5S,7R,8R)-9,11(13)-Ratibidadien-12,8-olide 86.11
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		 84.21
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		 84.21
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		 84.21
C00017349 Furanofukinol 84.21
C00017357 Tetradymodiol 84.21
C00017371 6beta-Methoxyfuranoeremophilane
Furanofukinin
Petasalbin methyl ether		 84.21
C00017396 Palmosalide A 84.21
C00017410 Euryopsonol 84.21
C00017439 2-Oxo-eremophila-1(10),11(13)-dien-12,8beta-olide 84.21
C00020779 5alpha-Hydroxy-eudesma-4(15),7(11),8(9)-trien-8,12-olide 84.21
C00044956 Neolitacumone C
(+)-Neolitacumone C		 84.21
C00046479 Tubipolide F
(-)-Tubipolide F		 84.21
C00012525 Lagopodin A 83.78
C00016962 Shizukanolide B
Chloranthalactone A		 83.78
C00038842 Cordiaquinol C 83.78
C00007236 Abscisic acid aldehyde 83.33
C00011591 Bilobanon
Bilobanone		 83.33
C00011970 (+)-Aoifuranone
Aoifuranone		 83.33
C00012353 Isofuranodienone 83.33
C00012354 Furanocaulesone A 83.33
C00012513 (S)-2,2,3-Trimethyl-3-(4-methylphenyl)cyclopentanone
Cyclopentanone, 2,2,3-trimethyl-3-p-tolyl-, (S)-(+)-
(+)-alpha-Cuparenone
(+)-Cuparenone
alpha-Cuparenone		 83.33
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		 83.33
C00012560 [2S-(2alpha,5alpha,10S*)]-7-Bromo-2,3,4,5-tetrahydro-2,5,8,10-tetramethyl-2,5-methano-1-benzoxepin
(-)-Filiformin
Filiformin		 83.33
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		 83.33
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		 83.33
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		 83.33
C00012936 Lindestrene
(4aS-trans)-4,4a,5,6,8a,9-Hexahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan		 83.33
C00017007 (+)-Isopetasol
Isopetasol
3alpha-Hydroxy-eremophila-7(11),9-dien-8-one		 83.33
C00017014 Hydroxyeremophilone 83.33
C00017298 Cyclodebneyol 83.33
C00017326 Dugesialactone
[3aS-(3aalpha,4aalpha,5alpha,9aalpha)]-3a,4,4a,5,6,7,9,9a-Octahydro-4a,5-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one		 83.33
C00017331 Xanthanene
[3R-(3alpha,3aalpha,4abeta,5beta,9aalpha)]-3a,4,4a,5,6,7,9,9a-Octahydro-3,4a,5-trimethyl-naphtho[2,3-b]furan-2(3H)-one		 83.33
C00020157 Dihydropyrocurzerenone 83.33
C00021716 Spiroeuryolide 83.33
C00021920 Herbacin (terpene) 83.33
C00039369 Henridilactone B 83.33
C00040139 R-(-)-alpha-Cuparenone
(-)-R-(-)-alpha-Cuparenone		 83.33
C00041773 Pleodendione 83.33
C00042682 Laur-11-en-2,10-diol 83.33
C00046476 Tubipolide B
(-)-Tubipolide B		 83.33
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