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


and

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




INPUT WORD = C00038561 , 50% or more
[ Metabolite Name : Axinisothiocyanate N , (-)-Axinisothiocyanate N ]
Number of matched data : 116

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00038551 Axinisothiocyanate D
(+)-Axinisothiocyanate D		 92.68
C00038552 Axinisothiocyanate E
(+)-Axinisothiocyanate E		 92.68
C00038553 Axinisothiocyanate F
(-)-Axinisothiocyanate F		 92.68
C00038560 Axinisothiocyanate M
(-)-Axinisothiocyanate M		 92.68
C00038556 Axinisothiocyanate I
(+)-Axinisothiocyanate I		 90.70
C00013576 Epipolasin A
(1aR,3aS,7S,7aS,7bR)-Decahydro-7-isothiocyanato-1,1,3a,7-tetramethyl-1H-cyclopropa[a]naphthalene		 90.24
C00038554 Axinisothiocyanate G
(+)-Axinisothiocyanate G		 90.24
C00012823 Odontin
(3alpha,4aalpha,5alpha,6beta,8abeta)-Octahydro-3-hydroperoxy-5,6-dihydroxy-5,8a-dimethyl-3-(1-methylethenyl)-2(1H)-naphthalenone		 87.80
C00012909 [3S-(3alpha,3abeta,4abeta,8aalpha,9abeta)]-Decahydro-3a-hydroperoxy-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one 87.80
C00013577 (-)-Epipolasin A 87.80
C00021243 10alpha-Isothiocyanatoalloaromadendrane 87.80
C00021244 Axisothiocyanate 2 87.80
C00021666 Acanthene B 87.80
C00023426 3alpha-Hydroxynorambreinolid 87.80
C00038557 Axinisothiocyanate J
(+)-Axinisothiocyanate J		 87.80
C00038559 Axinisothiocyanate L
(-)-Axinisothiocyanate L		 87.80
C00048623 Axiplyn C
(+)-Axiplyn C		 87.80
C00022665 4alpha,5alpha-Epoxy-3-oxo-4(15)-dihydrocostic acid methyl ester 85.71
C00012784 [1R-(1alpha,2beta,4abeta,8aalpha)]-1-(Acetyloxy)decahydro-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol 85.37
C00012821 (1alpha,2beta,4aalpha,8aalpha)-N-[Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenyl]-formamide 85.37
C00012837 Quadrangulin A
[1S-(1alpha,2beta,4abeta,8aalpha)]-Decahydro-1-hydroxy-4a-methyl-alpha,8-bis(methylene)-2-naphthaleneacetic acid methyl ester		 85.37
C00012917 [3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-Decahydro-4a-hydroperoxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one
5alpha-Hydroperoxy-4(15),11(13)-eudesmadien-12,8beta-olide		 85.37
C00012919 5-Deoxy-5-hydroperoxy-5-epitelekin
[3aR-(3aalpha,4abeta,8abeta,9aalpha)]-Decahydro-4a-hydroperoxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one		 85.37
C00020406 11-Acetoxy-10(14)-guaien-4alpha-ol 85.37
C00021211 1-Isothiocyanatoaromadendrane 85.37
C00021241 Axamide 2 85.37
C00021245 Epipolasin B 85.37
C00021664 10-Isothiocyanatoguai-6-ene 85.37
C00022668 5alpha-Hydroperoxycostic acid methyl ester 85.37
C00022670 3beta,5alpha-Dihydroxycostic acid methyl ester 85.37
C00023400 7alpha-Hydroxy-14,15-dinor-8(17)-labden-13-one 85.37
C00023428 Acrostalic acid 85.37
C00023430 Ambreinolide 85.37
C00024005 Victoxinine 85.37
C00025381 Deacetylpaniculine 85.37
C00028524 Lycoposerramine K 85.37
C00028525 Lycoposerramine L 85.37
C00037301 Integrifonol A
(+)-Integrifonol A		 85.37
C00042487 Eminensin B
(+)-Eminensin B		 85.37
C00046490 Ulosin B
(+)-Ulosin B		 85.37
C00049930 2-(Formylamino)trachyopsane
(-)-2-(Formylamino)trachyopsane		 85.37
C00048621 Axiplyn A
(+)-Axiplyn A		 84.09
C00022669 3beta-Hydroxy-5alpha-Hydroperoxycostic acid methyl ester 83.72
C00048624 Axiplyn D 83.72
C00012096 Peroxyparthenolide 83.33
C00022676 14-Hydroxy-5alpha-hydroperoxy-isoalantolactone 83.33
C00022679 5alpha-Hydroperoxyasperilin 83.33
C00023410 Isoacrostalidic acid 83.33
C00038193 1-O-Acetylageratriol
(+)-1-O-Acetylageratriol		 83.33
C00001937 Fawcettimine
(-)-Fawcettimine		 82.93
C00001970 Dendrobine 82.93
C00002229 Nuttalline
4-beta-Hydroxylupanine
7-Hydroxylupanine		 82.93
C00003213 (+)-Arbusculin A
Arbusculin A
[3aS-(3aalpha,5abeta,9alpha,9aalpha,9bbeta)]-Decahydro-9-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 82.93
C00003296 Granilin 82.93
C00011702 [1S-(1R*,4S*,5E,7R*)]-4-Methyl-10-methylene-7-(1-methylethyl)-1-acetate 5-cyclodecene-1,4-diol 82.93
C00011923 (+)-Yingzhosu A
Yingzhaosu A		 82.93
C00012001 8-Acetoxyelemol
8alpha-Acetoxyelemol		 82.93
C00012427 [1S-(1R*,2E,4R*,5R*,6E,10R*)]-3,7,11,11-Tetramethylbicyclo[8.1.0]undeca-2,6-diene-4,5-diol 5-acetate 82.93
C00012429 (-)-1,10-Epoxy-14-hydroperoxy-4-lepidozene
1,10-Epoxy-14-hydroperoxy-4-lepidozene		 82.93
C00012436 (-)-1,10-Epoxy-5-hydroperoxy-4(14)-lepidozene
1,10-Epoxy-5-hydroperoxy-4(14)-lepidozene		 82.93
C00012694 Arbusculin E
[1S-(1alpha,2beta,4abeta,8alpha,8aalpha)]-Decahydro-1,8-dihydroxy-4a,8-dimethyl-a-methylene-2-naphthaleneacetic acid		 82.93
C00012704 6alpha,15alpha-Epoxy-1beta,4beta-dihydroxyeudesmane
[2aS-(2aalpha,5alpha,5aalpha,8alpha,8aalpha,8bbeta)]-Octahydro-5a-methyl-8-(1-methylethyl)-2H-naphtho[1,8-bc]furan-2a,5(3H)-diol		 82.93
C00012729 [2R-(2alpha,3alpha,4alpha,4aalpha,8abeta)]-Decahydro-3,4-dihydroxy-4a-methyl-alpha,8-bis(methylene)-2-naphthaleneacetic acid
8beta,9beta-Dihydroxycostic acid		 82.93
C00012730 [2S-(2alpha,4alpha,4aalpha,5alpha,8abeta)]-Decahydro-4,5-dihydroxy-4a-methyl-alpha,8-bis(methylene)-2-naphthaleneacetic acid
1beta,9beta-Dihydroxycostic acid		 82.93
C00012767 Rupestrinol
[1S-(1alpha,4beta,4abeta,5beta,6beta,8aalpha)]-Decahydro-4-(hydroxymethyl)-8a-methyl-6-(1-methylethyl)-1,4,5-naphthalenetriol		 82.93
C00012787 alpha-Epoxykudtdiol
[1R-[1alpha,4abeta,7beta(R*),8aalpha]]-2-(Octahydro-4a-methylspiro[naphthalene-1(2H),2'-oxiran]-7-yl)-1,2-propanediol		 82.93
C00012871 Pulchellin C
[3aR-(3aalpha,4aalpha,6beta,7alpha,8abeta,9aalpha)]-Decahydro-6,7-dihydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one		 82.93
C00012875 [3aR-(3aalpha,4aalpha,5alpha,8alpha,8abeta,9aalpha)]-Decahydro-5,8-dihydroxy-5,8a-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one 82.93
C00012981 [3aR-(3aalpha,4alpha,5abeta,6alpha,9aalpha,9bbeta)]-Decahydro-4,6-dihydroxy-5a-methyl-3,9-bis(methylene)-naphtho[1,2-b]furan-2(3H)-one 82.93
C00012992 [3aR-(3aalpha,5abeta,7alpha,9balpha)]-3a,4,5,5a,6,7,8,9b-Octahydro-3a,7-dihydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one 82.93
C00012996 Rothin B
[3aR-(3aalpha,4alpha,5abeta,9aalpha,9bbeta)]-Decahydro-4,9a-dihydroxy-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one		 82.93
C00012998 [3S-(3alpha,3aalpha,5abeta,6beta,9alpha,9aalpha,9bbeta)]-Decahydro-6,9-dihydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one 82.93
C00013003 1beta-Hydroxyarbusculin A
[3aS-(3aalpha,5abeta,6beta,9alpha,9aalpha,9bbeta)]-Decahydro-6,9-dihydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 82.93
C00013004 Dendroserin
[3S-(3alpha,3aalpha,5abeta,6beta,9beta,9aalpha,9bbeta)]-Decahydro-6,9-dihydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 82.93
C00013006 Artapshin
[3S-(3alpha,3aalpha,4alpha,5abeta,6beta,9aalpha,9bbeta)]-Decahydro-4,6-dihydroxy-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2(3H)-one		 82.93
C00013027 Ludovicin A
[1aR-(1aalpha,3beta,3aalpha,5abeta,8aalpha,8bbeta,8calpha)]-Decahydro-3-hydroxy-3a,8c-dimethyl-6-methyleneoxireno[7,8]naphtho[1,2-b]furan-7(2H)-one		 82.93
C00013028 Epoxysantamarin
[1aR-(1aalpha,3alpha,3aalpha,5abeta,8aalpha,8bbeta,8calpha)]-Decahydro-3-hydroxy-3a,8c-dimethyl-6-methyleneoxireno[7,8]naphtho[1,2-b]furan-7(2H)-one		 82.93
C00013029 Maritimin (sesquiterpene)
[3aR-(3aalpha,5abeta,6beta,8aalpha,8bR*,9aalpha)]-Hexahydro-3a,6,9a-trimethyl-2H-oxireno[8,8a]naphtho[1,2-b]furan-3,7(3aH,6H)-dione		 82.93
C00013055 11,13-Dihydroarbusculin A
Colartin
[3S-(3alpha,3aalpha,5abeta,9alpha,9aalpha,9bbeta)]-Decahydro-9-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 82.93
C00013083 Shonachalin B
Decahydro-3-hydroxy-3a,6,8c-trimethyloxireno[7,8]naphtho[1,2-b]furan-7(2H)-one		 82.93
C00013244 Axamide 1
[1R-[1alpha(S*),3aalpha,7aalpha]]-N-[2-Methyl-1-(octahydro-3a-methyl-7-methylene-1H-inden-1-yl)propyl]formamide		 82.93
C00013549 Axisothiocyanate 1
(1R,3aR,7aR)-Octahydro-1-[(1S)-1-isothiocyanato-2-methylpropyl]-3a-methyl-7-methylene-1H-indene		 82.93
C00013555 Octahydro-1-(1-methoxy-2-methylpropyl)-3a-methyl-7-methylene-1H-inden-4-ol 82.93
C00017013 [1R-(1alpha,4aalpha,5alpha)]- 1-(Acetyloxy)-3,4,4a,5,6,7-hexahydro-4a,5-dimethyl-3-(1-methylethylidene)-2(1H)-naphthalenone 82.93
C00020110 Panal 82.93
C00020259 6alpha,7beta-Dihydroxydiihydrodrimenin 82.93
C00020266 Uvidin B 82.93
C00020762 Dendocarbin N 82.93
C00020888 [3R-(3alpha,3aalpha,4aalpha,6beta,7aalpha,9abeta)]-Decahydro-4a,6-dihydroxy-3-methyl-5,8-bis(methylene)-azuleno[6,5-b]furan-2(3H)-one 82.93
C00021281 (-)-Cyperenyl acetate 82.93
C00021391 Carotdiol acetate 82.93
C00021427 6-Isodaucene 14-isothiocyanate 82.93
C00021665 10-Isothiocyanato-4-cadinene 82.93
C00021668 (1R,6S,7S,10S)-10-Isothiocyanato-4-amorphene
10-Isothiocyanato-4-amorphene		 82.93
C00023401 19-Hydroxy-15,16-dinor-8(17)-labden-13-one 82.93
C00023427 (-)-Sclareolide
ent-Norambreinolide		 82.93
C00025380 Deacetyllycoclavine 82.93
C00025392 Lycophlegmine 82.93
C00026287 (+)-Chamaetine
Chamaetine
Epinuttaline		 82.93
C00026317 4-Hydroxylupanine 82.93
C00028506 Lyconesidine A 82.93
C00029660 Alismorientol A 82.93
C00029918 Cedryl acetate
8betaH-Cedran-8-ol acetate		 82.93
C00030115 Dendronobilin N 82.93
C00033538 1beta,4beta,7alpha-Trihydroxyeudesmane
(-)-1beta,4beta,7alpha-Trihydroxyeudesmane		 82.93
C00034373 1beta-Hydroxy-11-epi-colartrin 82.93
C00037585 Orientalol E
(+)-Orientalol E		 82.93
C00038548 Axinisothiocyanate A
(-)-Axinisothiocyanate A		 82.93
C00038549 Axinisothiocyanate B
(-)-Axinisothiocyanate B		 82.93
C00038550 Axinisothiocyanate C
(+)-Axinisothiocyanate C		 82.93
C00038558 Axinisothiocyanate K
(+)-Axinisothiocyanate K		 82.93
C00042837 Peroxygibberol
(+)-Peroxygibberol		 82.93
C00044694 Deacetyl-beta-cyclopyrethrosin 82.93
C00044741 Eleganolactone A 82.93
C00046435 Strychnistenolide 82.93
C00048255 1beta,4beta,6beta-Trihydroxyeudesmane 82.93
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