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


and

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




INPUT WORD = C00010984 , 50% or more
[ Metabolite Name : 3-Hydroxy-4,6,6-trimethyl-1,4-Cyclohexadiene-1-carboxaldehyde 4-hydroxy-3-methylcrotonate acetate ]
Number of matched data : 67

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010983 3-Hydroxy-4,6,6-trimethyl-1,4-Cyclohexadiene-1-carboxaldehyde 2-(hydroxymethyl)crotonate acetate 97.73
C00003104 Botrydial 86.67
C00010985 1,1,5-Trimethyl-2-formyl-4-(E)-3-hydroxymethyl-2-butenoyloxy)-2,5-cyclohexadiene 86.36
C00041808 Russujaponol B
(-)-Russujaponol B		 86.36
C00046434 Strychnilactone
(-)-Strychnilactone		 85.42
C00020294 Cinnamosmolide 84.78
C00021573 Dihydrobotrydial 84.78
C00033118 Lindenanolide G
(-)-Lindenanolide G		 84.78
C00000132 3-Acetoxy-13-hydroxy-1(10),4,7(11)-germacratrien-12,6-olide 84.44
C00000313 Xanthinin 84.44
C00012494 Naematolin
Nematolin
[1S-(1R*,4S*,5E,7S*,8R*,9R*)]-4-(Acetyloxy)-7,8-dihydroxy-6,10,10-trimethyl-2-methylenebicyclo[7.2.0]undec-5-en-3-one		 84.44
C00012495 Naematolon
Nematolone		 84.44
C00010374 3,3,6-Trimethyl-5-heptene-1,2,4-triol 84.09
C00013048 [3aS-(3aalpha,5beta,5abeta,9balpha)]-5-(Acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
9beta-Acetoxytournefortiolide		 84.09
C00016220 7-O-Demethyl-18-hydroxy-albocycline
Oxycineromycin B		 84.09
C00018117 ML 236C 84.09
C00020917 3beta-Acetoxy-5,11(13)-guaiadien-12,8alpha-olide 84.09
C00021018 3beta-Acetoxy-desoxo-achalensolide 84.09
C00021791 5alpha-Acetoxy-9(12)-capnellene-8beta,10alpha-diol 84.09
C00036189 Pectinolide A 84.09
C00041307 Acetoxyanthecotulide
(+)-Acetoxyanthecotulide		 84.09
C00012108 9alpha-Acetoxyparthenolide 82.61
C00012200 Herbolide C 82.61
C00012972 Isoludalbin
[3aR-(3aalpha,4alpha,5abeta,6alpha,9aalpha,9bbeta)]-6-(acetyloxy)-3a,4,5,5a,6,7,9a,9b-Octahydro-4-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 82.61
C00012973 Ludalbin
[3aR-(3aalpha,4alpha,5abeta,6alpha,9aalpha,9bbeta)]-4-(acetyloxy)-3a,4,5,5a,6,7,9a,9b-Octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 82.61
C00012975 alpha-Liriodenolide
[3aR-(3aalpha,4beta,5abeta,6beta,9aalpha,9bbeta)]-4-(acetyloxy)-3a,4,5,5a,6,7,9a,9b-octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 82.61
C00012978 gamma-Liriodenolide
[3aR-(3aalpha,4beta,5abeta,6beta,9bbeta)]-4-(acetyloxy)-3a,4,5,5a,6,7,8,9b-Octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 82.61
C00020805 Montanone
Montanone(terpene)		 82.61
C00020816 11,12-Dehydromatricarin
Dehydromatricarin A
(+)-Dehydromatricarin A		 82.61
C00021090 Ergolide
Dihydrobigelovin		 82.61
C00021542 3-O-Ethyllactarolide A 82.61
C00021544 3-O-Ethyllactarolide B 82.61
C00021786 8beta-Acetoxy-9(12)-capnellene-8beta,10alpha,14-triol 82.61
C00022142 Albocycline M-7 82.61
C00022145 Albocycline M-6 82.61
C00022613 15-Hydroxy-8,9-dioxo-seco-ent-labd-13E-ene 82.61
C00034392 3-Oxa-achillicin
8-Acetylegeloide		 82.61
C00034766 CID is old! 82.61
C00000133 13-Acetoxy-3-hydroxy-1(10),4,7(11)-germacratrien-12,6-olide 82.22
C00003117 Cinnamodial 82.22
C00003395 Xanthumin 82.22
C00011386 Flexilin 82.22
C00011818 15-Acetoxy-8alpha-hydroxycostunolide 82.22
C00012329 Tulirinol 82.22
C00021089 5-Senecioylnerolidol 82.22
C00023406 Wentilactone B 82.22
C00023946 Neovasinin 82.22
C00041255 1-O-Acetylbritannilactone
Britannilactone 1-O-acetate		 82.22
C00003105 Buddledin A 81.82
C00003372 Tenulin 81.82
C00011390 (E,E)-5-[5-[4-(Acetyloxy)-2-methyl-2-butenyl]-2,5-dihydro-2-oxo-3-furanyl]-2-methyl-2-pentenal 81.82
C00012449 [1S-(1R*,4Z,6R*,11S*)]-4,7,7,11-Tetramethyl-12-oxabicyclo[9.1.0]dodec-4-en-6-ol acetate 81.82
C00012774 [1R-(1alpha,4abeta,7beta,8alpha,8aalpha)]-Decahydro-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-1,8-naphthalenediol 1-acetate 81.82
C00013053 1alpha-Acetoxy-11beta(H),13-dihydrodouglanin
[3S-(3alpha,3aalpha,5abeta,6alpha,9aalpha,9bbeta)]-6-(Acetyloxy)-3a,4,5,5a,6,7,9a,9b-octahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 81.82
C00020293 Bemarivolide 81.82
C00020440 Chlorohyssopifolin B 81.82
C00021654 7-Hydroxy-10-methoxydeacetyldihydrobotrydial 81.82
C00021789 3beta-Acetoxy-9(12)-capnellene-8beta,10alpha-diol 81.82
C00021913 4-Acetoxy-10-hydroxy-2,8-neolemnadien-5-one 81.82
C00023372 Secomanool 81.82
C00030613 Kikkanol D monoacetate
(-)-Kikkanol D monoacetate		 81.82
C00030616 Kikkanol F monoacetate
(-)-Kikkanol F monoacetate		 81.82
C00030927 Paralemnolin G
(+)-Paralemnolin G		 81.82
C00033142 Madolin G 81.82
C00042880 Pulicanadienal B
(+)-Pulicanadienal B		 81.82
C00045183 4alpha-Hydroxy-5beta-acetoxy-epi-cubenol
(+)-4alpha-Hydroxy-5beta-acetoxy-epi-cubenol		 81.82
C00047971 Linderagalactone B
(-)-Linderagalactone B		 81.82
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