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


and

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




INPUT WORD = C00012028 , 50% or more
[ Metabolite Name : Zinaflavin A ]
Number of matched data : 58

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012027 (+)-Zinaflavin B
Zinaflavin B		 98.15
C00012057 Zinaflavin H 96.30
C00011985 [3aS-[3aalpha,4beta,5beta,6alpha,7alpha(Z),7abeta]]- 6-Ethenyl-5-(1-formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-2-oxo-7-benzofuranyl ester 2-methyl-2-butenoic acid 94.44
C00011765 Melampodin C 92.59
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 92.59
C00011991 [3aS-[3aalpha,4beta,5beta,6alpha(S*),7alpha,7abeta]]-5-(1-Formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-7-benzofuranyl ester 2-methyl-2-propenoic acid 92.59
C00012056 Zinaflavin G 92.59
C00044994 Pachyclavulariolide R
(-)-Pachyclavulariolide R		 92.59
C00012031 Zinaflavin D 91.23
C00012032 Zinaflavin E 91.23
C00011988 [3aS-[3aalpha,4beta,5beta,6alpha(S*),7alpha(Z),7abeta]]-5-(1-Formylethenyl)octahydro-4-hydroxy-6-methyl-3-methylene-6-oxiranyl-2-oxo-7-benzofuranyl ester 2-methyl-2-butenoic acid 91.07
C00011996 Zempoalin C 90.91
C00012060 Verafinin C 90.91
C00003384 Vernodalin 90.74
C00011981 Zinarosin 90.74
C00011984 [3aS-[3aalpha,4beta(Z),5beta,6alpha,7alpha,7abeta]]- 6-Ethenyl-5-(1-formylethenyl)octahydro-7-hydroxy-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-butenoic acid 90.74
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
C00011992 Zinaflorin V 90.74
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 90.74
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 90.74
C00044993 Pachyclavulariolide Q
(+)-Pachyclavulariolide Q		 90.74
C00049405 Tomenphantin B 90.74
C00011990 [3aS-[3aalpha,4beta(Z),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-butenoic acid 89.29
C00013213 [3aS-(3aalpha,4alpha,4abeta,6alpha,9alpha,9aalpha,10beta,10aalpha)]-Dodecahydro-10-hydroxy-9a-methyl-3,5-bis(methylene)-2-oxo-6,9-epoxyfuro[2,3-h][3]benzoxepin-4-yl ester 2-methyl-2-propenoic acid 89.09
C00003335 Multigilin 88.89
C00011841 Vicolide B 88.89
C00011980 Schkuhridin A 88.89
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 88.89
C00012053 [3aS-[3aalpha,4alpha,5beta(Z),6beta,7alpha,7aalpha]]-6-Ethenyloctahydro-3a,4-dihydroxy-6-methyl-3-methylene-7-(1-methylethenyl)-2-oxo-5-benzofuranyl ester 2-methyl-2-butenoic acid 88.89
C00012055 (+)-Elemacarmanin
Elemacarmanin		 88.89
C00012341 Ineupatorolide A 88.89
C00012342 Ineupatorolide B
Nepalolide C		 88.89
C00012863 2,3,3a,4,4a,7,8,8a,9,9a-Decahydro-7-hydroxy-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-8-yl ester 2-methylbutanoic acid 88.89
C00012874 Pulchellin F
[3aR-[3aalpha,4aalpha,6beta,7alpha(Z),8abeta,9aalpha]]-Dodecahydro-6-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-7-yl ester 2-methyl-2-butenoic acid		 88.89
C00012956 Tanapsin
[3aR-[3aalpha,4alpha(Z),4aalpha,5beta,8beta,8abeta,9abeta]]-Dodecahydro-5,8-dihydroxy-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid		 88.89
C00013097 Vahlenin
(Dodecahydro-6,9-dihydroxy-5a-methyl-3-methylene-2-oxonaphtho[1,2-b]furan-9-yl)methyl ester 2-methyl-2-propenoic acid		 88.89
C00020505 Epicentaurepensin
Linichlorin B		 88.89
C00021030 Hymenoratin B 88.89
C00035782 15-O-Isovaleroyl-2alpha-hydroxyamphoricarpolide 88.89
C00039365 Helivypolide D 88.89
C00040136 Querciformolide D
(-)-Querciformolide D		 88.89
C00040309 Sinulaflexiolide B
(+)-Sinulaflexiolide B		 88.89
C00040317 Sinulariolone
(-)-Sinulariolone		 88.89
C00011973 Isolaserolide 87.72
C00012029 (+)-Zinaflavin C
Zinaflavin C		 87.72
C00013212 Zinaflorin IV
(2Z)-(3aS,4R,4aS,6S,9R,9aR,10R,10aS)-Dodecahydro-10-hydroxy-9a-methyl-3,5-bis(methylene)-2-oxo-6,9-epoxyfuro[2,3-h][3]benzoxepin-4-yl ester 2-methyl-2-butenoic acid		 87.72
C00011842 Vicolide D 87.50
C00011993 Zinaflorin II 87.50
C00012145 Tithonin 87.50
C00011997 Disynaphiolide 87.27
C00012058 (+)-20-Hydroxyelemajurinelloide 87.27
C00012318 Lobatin A 87.27
C00012403 Eremantholide B 87.27
C00012984 (+)-Tirotundifolin A
Tirotundifolin A		 87.27
C00020588 Subacaulin 87.27
C00022664 8beta-Acetoxy-3beta-propionyloxyisocostic acid methyl ester 87.27
C00031933 Junceellolide H
(-)-Junceellolide H		 87.27
C00049151 Eremopetasitenin A1
(-)-Eremopetasitenin A1		 87.27
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