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


and

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





INPUT WORD = C00012114 , 50% or more
[ Metabolite Name : Ladibranolide ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00011844 Calein F
Caleine F
98.15
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
96.30
C00039365 Helivypolide D 96.30
C00011868 Argophyllin C 94.44
C00011871 Cordifolia 54 94.44
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 94.44
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 94.44
C00012084 (-)-Blumealactone A
Blumealactone A
94.44
C00012116 (-)-Lychnopholide
Lychnopholide
94.44
C00012119 15-Deoxybudlein A
Atripliciolide angelate
94.44
C00012977 Tirotundifolin D
[3aR-[3aalpha,4beta(Z),5abeta,6beta,9aalpha,9bbeta]]-2,3,3a,4,5,5a,6,7,9a,9b-decahydro-6-hydroxy-5a,9-dimethyl-3-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 2-(hydroxymethyl)-2-butenoic acid
94.44
C00012987 Trichomatolide E
[3aR-[3aalpha,4beta(E),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-(hydroxymethyl)-2-butenoic acid
94.44
C00013087 Trichomatolide C
[3aR-[3aalpha,4beta(E),5abeta,6beta,8alpha,9bbeta]]- 2,3,3a,4,5,5a,6,7,8,9b-Decahydro-6,8-dihydroxy-5a,9-dimethyl-3-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid
94.44
C00013094 (-)-Decipienin F
Decipienin F
[3S-[3alpha(Z),3aalpha,5aalpha,6alpha,9alpha,9abeta,9balpha]]- 2,3,3a,4,5,5a,6,9,9a,9b-Decahydro-6,9-dihydroxy-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-3-yl ester 2-methyl-2-butenoic acid
94.44
C00013096 Decipienin D
[3alpha(Z),3abeta,5aalpha,6beta,9alpha,9abeta,9balpha]-(-)-2,3,3a,4,5,5a,6,9,9a,9b-Decahydro-6,9-dihydroxy-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-3-yl ester 2-methyl-2-butenoic acid
94.44
C00020575 Eupassessifolide B 94.44
C00020964 11,13-Dihydroarnifolin 94.44
C00021174 Arnifolin 94.44
C00042506 Eupakirunsin D
(-)-Eupakirunsin D
94.44
C00012092 Lychnophorolide A
Centratherin
92.98
C00003338 Niveusin C 92.86
C00012153 (-)-Argophyllone B
Argophyllone B
92.86
C00036423 1alpha,4alpha,10alpha-Trihydroxy-9alpha-angeloyloxyguaia-2,11(13)-dien-12,6alpha-olide 92.86
C00012058 (+)-20-Hydroxyelemajurinelloide 92.73
C00012316 [3aS-[3aR*,4R*(Z),5R*,6R*,10E,11aS*]]-2,3,3a,4,5,6,7,8,9,11a-Decahydro-5,6-dihydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca[b]furan-4-yl ester 2-methyl-2-butenoic acid 92.73
C00012403 Eremantholide B 92.73
C00020598 Eupasessifolide A 92.73
C00000235 Heliangine 92.59
C00003335 Multigilin 92.59
C00011843 (+)-Caleine E
Calein E
92.59
C00011845 Neurolenin A 92.59
C00011846 Trichomoriolide 92.59
C00011867 (Z,Z)-Heliangin
Leptocarpin
92.59
C00012082 Euperfolin 92.59
C00012085 (-)-Blumealactone B
Blumealactone B
92.59
C00012154 Tagitinin A 92.59
C00012244 Jamaicolide C
(2Z)-(3aR,4R,7R,9S,10Z,11aR)-2,3,3a,4,5,6,7,8,9,11a-Decahydro-7,9-dihydroxy-10-methyl-3,6-bis(methylene)-2-oxocyclodeca[b]furan-4-yl ester 2-methyl-2-butenoic acid
92.59
C00012245 Calbertolide C
(2E)-(3aR,4R,7R,9S,10Z,11aR)-2,3,3a,4,5,6,7,8,9,11a-Decahydro-7,9-dihydroxy-10-methyl-3,6-bis(methylene)-2-oxocyclodeca[b]furan-4-yl ester 2-methyl-2-butenoic acid
92.59
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
92.59
C00012976 (+)-Tirotundifolin C
Tirotundifolin C
(3aR,4R,5aR,6R,9aS,9bR)-[partial]- 2,3,3a,4,5,5a,6,7,9a,9b-Decahydro-6-hydroxy-5a,9-dimethyl-3-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 3-hydroxy-2-methylenebutanoic acid
92.59
C00012979 Chapinolin
[3aR-[3aalpha,4alpha(Z),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid
92.59
C00012983 Arturin
[3aR-[3aalpha,4beta(Z),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid
92.59
C00020505 Epicentaurepensin
Linichlorin B
92.59
C00020957 3-O-Angeloylcarolenalone 92.59
C00020958 3-O-Tigloylcarolenalone 92.59
C00021173 Flexusin B 92.59
C00023191 8beta-Tigloyloxy-3beta,14-dihydroxy-6betaH,7alphaH-germacra-1(10)Z,4E-11(13)-trien-6,12-olide 92.59
C00033593 8alpha-Angeloyloxydouglanin 92.59
C00033596 8alpha-Tigloyloxydouglanin 92.59
C00042125 3-epi-Heliangin
(-)-3-epi-Heliangin
92.59
C00043496 Eupachinilide D
(-)-Eupachinilide D
92.59
C00046290 Penninervin
(-)-Penninervin
92.59
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