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


and

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




INPUT WORD = C00034536 , 50% or more
[ Metabolite Name : Hierapolitanin A , (+)-Hierapolitanin A ]
Number of matched data : 51

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00020735 Repdiolide 96.15
C00003208 Alatolide 96.08
C00011857 Vernopectolide B 96.08
C00011981 Zinarosin 96.08
C00013210 (-)-Eriolanin
Eriolanin
[3aalpha,4alpha,5(S*),7aalpha]-(-)- 2,3,3a,4,7,7a-Hexahydro-6-(hydroxymethyl)-5-(4-hydroxy-1-methylbutyl)-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid		 96.08
C00003384 Vernodalin 94.44
C00012061 11,13-Dihydrovernodalin 94.44
C00011887 Tagitinin D
Tirotundin		 94.23
C00012113 Zexbrevin 94.23
C00011843 (+)-Caleine E
Calein E		 94.12
C00011848 1(10)E-Millerenolide 94.12
C00011977 Isoarbutifolin 94.12
C00011982 [3aS-(3aalpha,4beta,5beta,6alpha,7abataethenyl-5-(1-formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid 94.12
C00012299 Arcotiopicrin
Orientin (sesquiterpene)		 94.12
C00012868 Subcordatolide C
[3aR-(3aalpha,4alpha,4aalpha,8beta,8abeta,9aalpha)]-Dodecahydro-8-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-propanoic acid		 94.12
C00020511 Aguerin A 94.12
C00020512 Aguerin B 94.12
C00003257 Eremantholide A 92.45
C00011847 Eupachifolin A 92.45
C00011998 [3aR-[3aalpha,4beta(Z),6alpha,7beta,7abeta]]-6-Ethenyloctahydro-6-methyl-a,3-bis(methylene)-4-[(2-methyl-1-oxo-2-butenyl)oxy]-2-oxo-7-benzofuranacetic acid 92.45
C00011999 [3aR-[3aalpha,4beta(E),6alpha,7beta,7abeta]]-6-ethenyloctahydro-6-methyl-a,3-bis(methylene)-4-[(2-methyl-1-oxo-2-butenyl)oxy]-2-oxo-7-benzofuranacetic acid 92.45
C00012399 Zinangustolide 92.45
C00020594 19-Deoxyjanerin
Desoxyrepin		 92.45
C00003243 Cynaropicrin 92.31
C00003366 Saupirin
sauparine		 92.31
C00011865 Erioflorin 92.31
C00012115 Ciliarin 92.31
C00012117 15-Deoxygayazensolide 92.31
C00020858 Subcordatolide A 92.31
C00049404 Tomenphantin A 92.31
C00049405 Tomenphantin B 92.31
C00011850 9-Hydroxyglabratolide 92.16
C00011856 Tagitinin C 92.16
C00011976 11,13-Dehydromelitensin diacetate 92.16
C00011983 [3aS-(3aalpha,4beta,5beta,6alpha,7alpha,7abeta)]-6-Ethenyl-5-(1-formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-2-oxo-7-benzofuranyl ester 2-methyl-2-propenoic acid 92.16
C00012056 Zinaflavin G 92.16
C00012266 Pectorolide 92.16
C00029909 Carlaolide A
(-)-Carlaolide A		 92.16
C00012058 (+)-20-Hydroxyelemajurinelloide 90.91
C00020736 Epoxyrepdiolide 90.91
C00011989 [3aS-[3aalpha,4beta,5beta,6alpha(S*),7alpha,7abeta]]-5-(1-Formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid 90.74
C00012154 Tagitinin A 90.74
C00013086 Trichomatolide B
[3aR-[3aalpha,4beta(E),5abeta,6beta,8alpha,9aalpha,9bbeta]]-Dodecahydro-6,8-dihydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid		 90.74
C00020505 Epicentaurepensin
Linichlorin B		 90.74
C00035782 15-O-Isovaleroyl-2alpha-hydroxyamphoricarpolide 90.74
C00011859 (3aR,4R,6E,10Z,11aR)-6-Formyl-2,3,3a,4,5,8,9,11a-octahydro-10-(hydroxymethyl)-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-methylbutanoic acid 90.57
C00011980 Schkuhridin A 90.57
C00012300 Resinosolide 90.57
C00012404 Eremantholide C 90.57
C00023191 8beta-Tigloyloxy-3beta,14-dihydroxy-6betaH,7alphaH-germacra-1(10)Z,4E-11(13)-trien-6,12-olide 90.57
C00049579 Desacetyl-neurolenin G
(-)-Desacetyl-neurolenin G		 90.57
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