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


and

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




INPUT WORD = C00013007 , 50% or more
[ Metabolite Name : Inucrithmolide , [3R-[3alpha,3abeta,5alpha,5aalpha,6beta(Z),9aalpha,9bbeta]]-5-(Acetyloxy)-2,3,3a,4,5,5a,6,7,9a,9b-decahydro-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-6-yl ester 2-methyl-2-butenoic acid ]
Number of matched data : 55

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00013009 Isosilerolide
[3S-[3alpha(Z),3aalpha,5aalpha,6beta,9abeta,9balpha]]-6-(Acetyloxy)-2,3,3a,4,5,5a,6,7,9a,9b-decahydro-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-3-yl ester 2-methyl-2-butenoic acid		 94.83
C00013010 Silerolide
[3S-(3alpha,3aalpha,5aalpha,6beta,9abeta,9balpha)]-6-(Acetyloxy)-2,3,3a,4,5,5a,6,7,9a,9b-decahydro-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-3-yl ester 3-methyl-2-butenoic acid		 93.10
C00020526 9beta-Hydroxy-8beta-(5-acetoxy-tiglinoyloxy)-lasiolaenin 91.67
C00012306 Calein A 90.16
C00020500 Eupachifolin C 90.00
C00033604 8-O-Tigloyl-9alpha-acetoxycumambrin B 90.00
C00011986 [3aS-[3aalpha,4beta(Z),5beta,6alpha,7alpha,7abeta]]-7-(Acetyloxy)-6-ethenyl-5-(1-formylethenyl)octahydro-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-butenoic acid 89.83
C00003313 Laserolide 89.66
C00011973 Isolaserolide 89.66
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		 89.66
C00021353 Bakkenolide B
Fukinolide		 89.66
C00021354 Bakkenolide E 89.66
C00038207 20-Acetylsinularolide C 89.66
C00012305 Piptolepolide 88.52
C00012307 Calein B 88.52
C00020589 Berlandin 88.52
C00049591 Neurolenin H 88.52
C00020527 8beta-Hydroxy-9beta-(5-acetoxy-tiglinoyloxy)-lasiolaenin 88.33
C00011987 [3aS-[3aalpha,4beta,5beta,6alpha,7alpha(Z),7abeta]]-4-(Acetyloxy)-6-ethenyl-5-(1-formylethenyl)octahydro-6-methyl-3-methylene-2-oxo-7-benzofuranyl ester 2-methyl-2-butenoic acid 88.14
C00012308 Calein C 88.14
C00049580 Lobatin D
(-)-Lobatin D		 88.14
C00049590 Neurolenin G 88.14
C00010964 [1S-[1alpha(E),3(E),5beta,6alpha]]-5-(acetyloxy)-6-(1-methylethyl)-3-[[(2-methyl-1-oxo-2-butenyl)oxy]methyl]-4-oxo-2-cyclohexen-1-yl ester 87.93
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 87.93
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 87.93
C00020487 [3aS-(3aalpha,4alpha,5alpha,9aalpha,9bbeta)]-5-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-6-methyl-3,9-bis(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester 2-methylpropanoic acid 87.93
C00020957 3-O-Angeloylcarolenalone 87.93
C00020958 3-O-Tigloylcarolenalone 87.93
C00021687 Salonitenolide 8-O-acetyl sarracinate 87.93
C00033602 8-O-Isobutyryl-9alpha-Acetoxycumambrin B 87.93
C00038206 20-Acetylsinularolide B 87.93
C00038576 Bakkenolide G
(-)-Bakkenolide G		 87.93
C00038970 Dendronpholide D
(-)-Dendronpholide D		 87.93
C00042359 Cembranolide A 87.93
C00036968 Cuminoside B 87.30
C00020859 Jamaicolide A 87.10
C00020879 8-Acetylpumilin
8-O-Acetyl pumilin		 87.10
C00045939 Ferupennin H
(+)-Ferupennin H		 87.10
C00011855 Acanthospermal B 86.89
C00012311 Neurolenin B 86.89
C00022673 8beta-Acetoxy-3beta-angeloyloxy-5alpha-hydroxycostic acid methyl ester 86.89
C00011807 8-(2R,3R,Epoxy-2-methylbutanoyl)-8alpha,9beta-dihydroxy-1(10)E,4E,11(13)-germacratrien-12,6beta-olide 86.67
C00020555 Laferin 86.67
C00020865 [3aS-(3aalpha,4alpha,5alpha,9beta,9aalpha,9bbeta)]-5-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-4-yl ester 2-methylbutanoic acid 86.67
C00048695 Durumolide A
(-)-Durumolide A		 86.67
C00003266 Eupacunin 86.44
C00003275 Eupatocunin 86.44
C00011792 Hiyodorilactone B 86.44
C00012233 Orientalide 86.44
C00012279 Linearilobin I 86.44
C00012312 Caleurticolide acetate 86.44
C00022663 8beta-Acetoxy-3beta-angeloyloxy-isocostic acid methyl ester 86.44
C00034537 Hierapolitanin B
(+)-Hierapolitanin B		 86.44
C00037086 Effusin 86.44
C00043500 Eupachinilide I
(+)-Eupachinilide I		 86.44
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