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


and

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




INPUT WORD = C00038562 , 50% or more
[ Metabolite Name : Axinynitrile A , (+)-Axinynitrile A ]
Number of matched data : 80

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00017472 (-)-1abeta,2,4alpha,5,6,7,7a,7bbeta-Octahydro-1,1,7beta,7abeta-tetramethyl-1H-cyclopropa[a]naphthalen-4-ol 88.89
C00029294 (+)-Aristolone 88.89
C00038563 Axinysone A
(+)-Axinysone A		 88.89
C00038564 Axinysone B
(+)-Axinysone B		 88.89
C00003108 Capsidiol 86.11
C00003258 Eremofrullanolide 86.11
C00007635 CID is old! 86.11
C00013550 Axisonitrile 1
(1R,3aR,7aR)-Octahydro-1-[(1S)-1-isocyano-2-methylpropyl]-3a-methyl-7-methylene-1H-indene		 86.11
C00013589 Ent-maaliane-5-ol
(1aS,3aR,7S,7aS,7bR)-Decahydro-1,1,3a,7-tetramethyl-7aH-cyclopropa[a]naphthalen-7a-ol		 86.11
C00016977 Capsenone 86.11
C00017009 (+)-Petasol
Petasol
Sencathenone		 86.11
C00017337 Dihydroeremofrullanolide 86.11
C00017470 alpha-Ferulene
(+)-9-Aristolene		 86.11
C00017471 Aristolene
(-)-9-Aristolene		 86.11
C00017475 1,10-Epoxy-aristolane
[1S-(1alpha,3abeta,4aR*,6aalpha,7aalpha,7balpha)]-Decahydro-1,7,7,7b-tetramethyl-cyclopropa[5,6]naphth[1,8a-b]oxirene		 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
C00021210 1-Isocyanoaromadendrane 86.11
C00021242 Axisonitrile 2 86.11
C00021426 6-Isodaucene 14-isonitrile 86.11
C00029559 (+)-5-epi-Aristolochene
5-epi-Aristolochene
(+)-Epiaristolochene		 86.11
C00041624 Lepadiformine C 86.11
C00049777 4alpha-Isocyanogorgon-11-ene 86.11
C00038566 Axinysone D
(-)-Axinysone D		 84.21
C00016997 Lateriflorol 83.78
C00035945 4(15)-Aromadendren-12,5alpha-olide
(+)-4(15)-Aromadendren-12,5alpha-olide		 83.78
C00003125 Debneyol 83.33
C00003306 Isoalantolactone
Isoallantolactone
Isohelenin		 83.33
C00012434 (-)-1,10-Epoxy-4(14)-lepidozen-5-ol
1,10-Epoxy-4(14)-lepidozen-5-ol		 83.33
C00012741 [1aR-(1aalpha,2alpha,4aalpha,7alpha,8aS*)]-Octahydro-1a,4a-dimethyl-7-(1-methylethenyl)-3H-naphth[1,8a-b]oxiren-2-ol
4alpha,5alpha-Epoxy-11-eudesmen-3alpha-ol		 83.33
C00012785 Arctiol
[2S-(2alpha,3beta,4aalpha,8abeta)]-Decahydro-3-hydroxy-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol		 83.33
C00012822 (1alpha,2beta,4aalpha,8aalpha)-Decahydro-1-isocyano-4a-methyl-8-methylene-2-(1-methylethyl)-naphthalene
6-Isocyano-4(15)-eudesmene		 83.33
C00012878 [3R-(3alpha,3aalpha,4abeta,8aalpha,9aalpha)]-Decahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one
Dihydroallitrisin		 83.33
C00013103 Deoxybaimuxinol
Dihydro-beta-agarofuran
trans-Dihydroagarofuran
[3R-(3alpha,5aalpha,9alpha,9aalpha)]-Octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin		 83.33
C00013104 4-Hydroxydihydroagarofuran
[3R-(3alpha,5aalpha,9alpha,9aalpha)]-Octahydro-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-9-ol		 83.33
C00016958 gamma-Maaliene 83.33
C00016959 (+)-Maaliol
Maaliol
Maali alcohol		 83.33
C00016976 (-)-Aristolochene
Aristolochen
Aristolochene		 83.33
C00016978 Dihydrocapsenone
[3R-(3alpha,4alpha,4abeta,6beta,8abeta)]-Octahydro-3-hydroxy-4,4a-dimethyl-6-(1-methylethenyl)-1(2H)-naphthalenone		 83.33
C00016981 [2R-(2alpha,8alpha,8aalpha)]-1,2,3,5,6,7,8,8a-Octahydro-8,8a-dimethyl-a-methylene-2-naphthaleneacetic acid 83.33
C00016991 Alloeremophilone
3-Desoxyneopetasol
Eremophila-9,11-dien-8-one
Neopetasan		 83.33
C00017001 (-)-Jinkoheremol
Jinkoheremol		 83.33
C00017003 Fukinone
(+)-Eremophil-7(11)-en-8-one		 83.33
C00017004 Isopetasan
Dehydrofukinone
3-Desoxyisopetasol		 83.33
C00017005 Eremofukinone 83.33
C00017007 (+)-Isopetasol
Isopetasol
3alpha-Hydroxy-eremophila-7(11),9-dien-8-one		 83.33
C00017016 [3S-(3alpha,4aalpha,5alpha,6beta,8aalpha)]-Octahydro-6-hydroxy-4a,5-dimethyl-3-(1-methylethenyl)-1(2H)-naphthalenone 83.33
C00017291 9-Oxo-1(10),11(13)-eremophiladien-12-al 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
C00017474 Aristolone 83.33
C00017514 Kanokonol
14-Hydroxyvaleranone		 83.33
C00021013 5,10-bis-epi-Isoalantolactone 83.33
C00021205 beta-Spathulene 83.33
C00021340 beta-Pinguisenediol 83.33
C00021648 Axisonitrile 3 83.33
C00021669 7-Isocyano-7,8-dihydro-a-bisabolene 83.33
C00021714 (4S,5S,7R,8R)-9,11(13)-Ratibidadien-12,8-olide 83.33
C00021715 (4S,5S,7R,8R)-10(14),11(13)-Ratibidadien-12,8-olide 83.33
C00021723 alpha-Biotol 83.33
C00021725 beta-Biotol 83.33
C00021734 4-Ketocedrol 83.33
C00021872 Ishwarol 83.33
C00021873 Ishwarone 83.33
C00021977 2-Isocyanopupukeanane 83.33
C00021978 9-Isocyanopupukeanane 83.33
C00021979 9-epi-9-Isocyanopupukeanane 83.33
C00022645 Medhephenepoxide 83.33
C00029881 Calarene
(+)-1(10)-Aristolene		 83.33
C00034456 beta-Gurjunene 83.33
C00035302 ent-4-epi-Maaliol 83.33
C00036292 (-)-trans-Selina-4(15),11-dien-5-ol 83.33
C00036300 (+)-Aristolochene 83.33
C00037367 Kanshone G
(-)-Kanshone G		 83.33
C00038050 (-)-Aromadendran-5-ol 83.33
C00039328 Halichonadin C
(-)-Halichonadin C		 83.33
C00039330 Halichonadin F
(+)-Halichonadin F		 83.33
C00040349 Spirolepechinene
(-)-Spirolepechinene		 83.33
C00040823 3-Hydroxyledene
(+)-3-Hydroxyledene		 83.33
C00042659 Lacinan-8-ol
(+)-Lacinan-8-ol		 83.33
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