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


and

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





INPUT WORD = C00045932 , 50% or more
[ Metabolite Name : Ferupennin A , (+)-Ferupennin A ]
Number of matched data : 61

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00045933 Ferupennin B
(+)-Ferupennin B
100.00
C00020806 Ferulide 94.23
C00045935 Ferupennin D
(-)-Ferupennin D
92.59
C00003333 Molephantin 92.31
C00020565 5-Desoxypumilim 90.74
C00020503 Acroptin 90.38
C00020821 Badkhyzin 90.38
C00020858 Subcordatolide A 90.38
C00034083 Notoserolide B
-O-Senecioylaustricin
90.38
C00045934 Ferupennin C
(+)-Ferupennin C
90.38
C00003334 Molephantinin 88.68
C00011841 Vicolide B 88.68
C00038329 8alpha-Epoxymethylacrylyloxyambrosin 88.68
C00003243 Cynaropicrin 88.46
C00003366 Saupirin
sauparine
88.46
C00011843 (+)-Caleine E
Calein E
88.46
C00011848 1(10)E-Millerenolide 88.46
C00011852 Acantholide 88.46
C00012261 Leucanthanolide 88.46
C00020486 8-Acetoxy-4-anhydroathamontanolide 88.46
C00020513 Dehydrocyanaropicrin 88.46
C00020735 Repdiolide 88.46
C00020815 Shairidin 88.46
C00020943 [3R-(3alpha,3aalpha,4alpha,4abeta,7abeta,8alpha,9aalpha)]-2,3,3a,4,4a,7,7a,8,9,9a-Decahydro-3,5,8-trimethyl-2,7-dioxoazuleno[6,5-b]furan-4-yl ester 3-methyl-2-butenoic acid 88.46
C00021162 Desacetyltetraneurin D 4-O-isobutyrate 88.46
C00021164 Isochiapin B 88.46
C00029909 Carlaolide A
(-)-Carlaolide A
88.46
C00034017 Lactucin-15-oxalate 88.46
C00034536 Hierapolitanin A
(+)-Hierapolitanin A
88.46
C00038458 Annuolide F 88.46
C00020598 Eupasessifolide A 87.27
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
87.04
C00020552 Vicolide A 87.04
C00020575 Eupassessifolide B 87.04
C00035782 15-O-Isovaleroyl-2alpha-hydroxyamphoricarpolide 87.04
C00011779 [3aR-[3aR*,4R*(S*),6E,8S*,10E,11aR*]]-2,3,3a,4,5,8,9,11a-Octahydro-8-hydroxy-6,10-dimethyl-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 3-hydroxy-2-methylene-butanoic acid 86.79
C00011847 Eupachifolin A 86.79
C00012265 Gigantanolide C 86.79
C00020594 19-Deoxyjanerin
Desoxyrepin
86.79
C00003215 Arctiopicrin 86.54
C00003341 Onopordopicrin 86.54
C00003360 Radiatin 86.54
C00011738 Acanthamolide 86.54
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 86.54
C00012056 Zinaflavin G 86.54
C00013008 (-)-Isolasolide
Isolasolide
[3S-[3alpha(Z),3aalpha,5aalpha,6alpha,9abeta,9balpha]]-2,3,3a,4,5,5a,6,7,9a,9b-Decahydro-6-hydroxy-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-3-yl ester 2-methyl-2-butenoic acid
86.54
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
86.54
C00013210 (-)-Eriolanin
Eriolanin
[3aalpha,4alpha,5(S*),7aalpha]-(-)- 2,3,3a,4,7,7a-Hexahydro-6-(hydroxymethyl)-5-(4-hydroxy-1-methylbutyl)-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-propenoic acid
86.54
C00020479 Angeloylcumambrin B 86.54
C00020484 9-Propanoyl-10-hydroxy-3,11(13)-guaiadien-12,6-olide 86.54
C00020623 [3aS-(3aalpha,7alpha,7abeta,8abeta,8balpha,8cbeta)]-2,3,3a,4,5,7,7a,8a,8b,8c-Decahydro-6,8a-dimethyl-3-methylene-2-oxooxireno[2,3]azuleno[4,5-b]furan-7-yl ester 2-methyl-2-propenoic acid 86.54
C00020798 Subexpinnatin 86.54
C00021161 Desacetyltetraneurin D 15-O-isobutyrate 86.54
C00030468 Hemistepsin 86.54
C00033595 8alpha-Isobutyryloxydouglanin 86.54
C00034772 5alpha-Hydroxymatricarin 86.54
C00038739 Chiapin B 86.54
C00039373 Hispitolide B 86.54
C00044993 Pachyclavulariolide Q
(+)-Pachyclavulariolide Q
86.54
C00049404 Tomenphantin A 86.54
C00049965 8beta-Isobutyryloxycumambranolide
(-)-8beta-Isobutyryloxycumambranolide
86.54
Page Top