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


and

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




INPUT WORD = C00021149 , 50% or more
[ Metabolite Name : 9-O-Desacetylspathulin 2-O-angelate , Gaigrandin ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00000167 Eupalinin B 90.32
C00011863 Eupalinin D 90.32
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 90.32
C00012302 [3aR-[3aR*,4R*(Z),6S*,9R*,10E,11aR*]]-9-(Acetyloxy)-2,3,3a,4,5,6,7,8,9,11a-decahydro-6-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxocyclodeca[b]furan-4-yl ester 2-methyl-2-butenoic acid
3alpha-Acetoxytrichomoriolide		 90.32
C00012303 Piptolepolide 90.32
C00012307 Calein B 90.32
C00021151 Pulchelloid A 90.32
C00021166 Acetylhymenograndin 90.32
C00021167 Hymenolane 90.32
C00021168 Hymenolane B 90.32
C00021152 Pulchelloid D 89.71
C00003264 Eupachlorin acetate 89.06
C00041978 Zinagrandinolide A
(+)-Zinagrandinolide A		 89.06
C00003273 Euparotin acetate 88.89
C00012955 [3aR-(3aalpha,4alpha,6beta,8alpha,8aalpha,9aalpha)]- 6,8-bis(Acetyloxy)-2,3,3a,4,6,7,8,8a,9,9a-decahydro-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-propenoic acid 88.89
C00020566 3alpha,4alpha-Epoxy-9-oxo-8beta-(5-acetoxy-tiglinoyloxy)-3,4-dihydro-lasiolaenin 88.89
C00020567 3alpha,4alpha-Epoxy-9beta-hydroxy-8beta-(5-acetoxy-tiglinoyloxy)-3,4-dihydro-lasiolaenin 88.89
C00020568 3alpha,4alpha-Epoxy-8beta-hydroxy-9beta-(5-acetoxy-tiglinoyloxy)-3,4-dihydro-lasiolaenin 88.89
C00020697 Zoapatanolide D 88.89
C00030485 Hispidunolide A 88.89
C00000169 1beta,10alpha-Epoxy-8beta-hydroxy-14-acetoxy-4E,11(13)-germacradien-12,6-olide 88.71
C00011872 Cordifolia 55 88.71
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 88.71
C00012273 Linearilobin C 88.71
C00012279 Linearilobin I 88.71
C00012400 Jamaicolide D 88.71
C00012951 [3aR-[3aalpha,4alpha(E),6beta,8alpha,8aalpha,9aalpha]]-6-(Acetyloxy)-2,3,3a,4,6,7,8,8a,9,9a-Decahydro-8-hydroxy-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid 88.71
C00012952 [3aR-[3aalpha,4alpha(E),6beta,8alpha,8aalpha,9aalpha]]-8-(acetyloxy)-2,3,3a,4,6,7,8,8a,9,9a-Decahydro-6-hydroxy-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid 88.71
C00020879 8-Acetylpumilin
8-O-Acetyl pumilin		 88.71
C00021148 Spathulin 88.71
C00041979 Zinagrandinolide B 88.71
C00020439 Eupachifolin D 87.50
C00020501 Eupachifolin B 87.30
C00022672 8beta-Acetoxy-3beta-angeloyloxy-5alpha-hydroperoxycostic acid methyl ester 87.30
C00003267 Eupacunolin 87.10
C00011855 Acanthospermal B 87.10
C00011862 Eupalinin C 87.10
C00011881 Longipilin 87.10
C00012062 (+)-Zempoalin D
Zempoalin D		 87.10
C00012138 Rotundin 87.10
C00020502 Eupahakonesin 87.10
C00020527 8beta-Hydroxy-9beta-(5-acetoxy-tiglinoyloxy)-lasiolaenin 87.10
C00020867 [3aS-[3aalpha,4alpha,5beta(Z),9alpha,9aalpha,9bbeta]]-4-(Acetyloxy)-2,3,3a,4,5,9,9a,9b-octahydro-9-hydroxy-6,9-dimethyl-3-methylene-2-oxoazuleno[4,5-b]furan-5-yl ester 2-methyl-2-butenoic acid 87.10
C00020881 Eufoliatin 87.10
C00021178 Britanin(-)-
Britannin		 87.10
C00030435 Guaiaglehnin A 87.10
C00042052 15-Acetoxyheliangin 87.10
C00046787 Junceellolide G
(-)-Junceellolide G		 87.10
C00048695 Durumolide A
(-)-Durumolide A		 87.10
C00049926 1-Acetyltagitinin A 87.10
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