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


and

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




INPUT WORD = C00020743 , 50% or more
[ Metabolite Name : [1R-(1alpha,4beta,4abeta,6alpha,8aalpha)]-6-(Acetyloxy)-4-ethoxy-1,2,3,4,4a,5,6,8a-octahydro-4,7-dimethyl-a-methylene-1-naphthaleneacetic acid methyl ester ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00020741 2-Acetylzafronic acid 92.16
C00020747 [1R-(1alpha,4alpha,4aalpha,6alpha,8aalpha)]-6-(Acetyloxy)-1,2,3,4,4a,5,6,8a-octahydro-4-hydroxy-4,7-dimethyl-a-methylene-1-naphthaleneacetic acid methyl ester 92.16
C00023368 2,3-Dicarboxy-2,3-secomanoyl oxide 92.16
C00011756 Millefin 90.20
C00022256 (ent-3beta,8beta,13Z)-3,8-Dihydroxy-17-oxo-13-labden-15-oic acid 90.20
C00022346 12-Acetylvarodiol 88.89
C00022751 6-Acetylisoandalusol 88.68
C00020891 Deoxyarctolide 88.46
C00020893 Carolenin 88.46
C00020959 3-O-TigloylCarolenalin 88.46
C00022302 Lagochilin 88.46
C00003386 Vernoflexin
Vernoflexine
Zaluzanin C senecioate		 88.24
C00011804 Sintenin 88.24
C00011823 Idomain 88.24
C00012081 Ligularinone B 88.24
C00012847 Decahydro-alpha,4a-dimethyl-8-methylene-7-[(3-methyl-1-oxo-2-butenyl)oxy]-2-naphthaleneacetic acid 88.24
C00012848 Decahydro-alpha,4a-dimethyl-8-methylene-7-[(2-methyl-1-oxo-2-butenyl)oxy]-2-naphthaleneacetic acid 88.24
C00012850 Decahydro-alpha,4a-dimethyl-8-methylene-7-(3-methyl-1-oxobutoxy)-2-naphthaleneacetic acid 88.24
C00020521 Diaspanolide A 88.24
C00020745 [1R-(1alpha,4beta,4abeta,6alpha,8aalpha)]-4-Ethoxy-1,2,3,4,4a,5,6,8a-octahydro-6-hydroxy-4,7-dimethyl-a-methylene-1-naphthaleneacetic acid methyl ester 88.24
C00022225 (E)-ent-3beta-3,18-Dihydroxy-8(17),13-labdadien-15-oic acid 88.24
C00022226 Henrilabdane A
(-)-Henrilabdane A		 88.24
C00022228 Methyl sciadopate 88.24
C00022269 3alpha-Hydroxygomeric acid 88.24
C00022380 8alpha,13R-Epoxy-14-labden-19-oic acid 88.24
C00022492 3-Oxo-18-hydroxy-8(17),13Z-labdadien-15-oic acid 88.24
C00022494 2beta,3beta-Dihydroxy-8(17),13Z-labdadien-15-oic acid 88.24
C00022516 ent-8beta,17-Epoxy-3-oxo-13Z-labden-15-oic acid 88.24
C00022522 Dehydropinifolic acid
8(17),13-labdadien-15,18-dioic acid		 88.24
C00022526 Guamaiac acid
ent-8(17),13-labdadien-15,18-dioic acid		 88.24
C00022666 3beta-Angeloyloxyisocostic acid methyl ester 88.24
C00023303 Junicedric acid 88.24
C00041322 Agathic acid 88.24
C00020897 Hymenosignin 86.79
C00020898 Hymenoratin F 86.79
C00020899 2-O-Tigloylhymenoratin E 86.79
C00020900 Hymenoratin E 86.79
C00022667 3beta-Angeloyloxy-4beta-hydroxy-delta5-costic aid methyl ester 86.79
C00022753 6-Acetylandalusol 86.79
C00029683 Andrographic acid 86.79
C00046540 (+)-Plumosol 86.79
C00000260 Momilactone B 86.54
C00020506 8alpha-Acetoxyzaluzanin D 86.54
C00021092 Ligulatin C 86.54
C00022255 14-Deoxy-11-oxoandrographolide 86.54
C00022771 Pinusolide 86.54
C00023362 Andrographolide 86.54
C00039003 Diacarperoxide B
(-)-Diacarperoxide B		 86.54
C00039004 Diacarperoxide C
(-)-Diacarperoxide C		 86.54
C00041336 Andropanolide
(-)-Andropanolide		 86.54
C00041651 Manaarenolide C
(-)-Manaarenolide C		 86.54
C00041652 Manaarenolide D
(-)-Manaarenolide D		 86.54
C00045623 Aikupikoxide D
(+)-Aikupikoxide D		 86.54
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