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


and

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




INPUT WORD = C00032115 , 50% or more
[ Metabolite Name : Patridoid I , (-)-Patridoid I ]
Number of matched data : 53

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00032116 Patridoid II
(-)-Patridoid II		 100.00
C00012289 Melcanthin E 87.30
C00034021 Lanceocrepidiaside A 87.30
C00012139 Vernopectolide A 86.89
C00031990 Lushanrubescensin I
(+)-Lushanrubescensin I		 86.89
C00012291 Melcanthin G 86.15
C00012298 [3aS-[3aR*,4R*(S*),5R*,6E,10R*,11aS*]]-5-(Acetyloxy)-2,3,3a,4,5,8,9,10,11,11a-decahydro-10-(hydroxymethyl)-3-methylene-4-(2-methyl-1-oxobutoxy)-2-oxocyclodeca[b]furan-6-carboxylic acid methyl ester
9alpha-Acetoxymelnerin B		 86.15
C00012288 Melcanthin D 85.71
C00012297 [3aS-(3aR*,4R*,5R*,6E,10R*,11aS*)]- 5-(Acetyloxy)-2,3,3a,4,5,8,9,10,11,11a-decahydro-10-(hydroxymethyl)-3-methylene-4-(2-methyl-1-oxopropoxy)-2-oxocyclodeca[b]furan-6-carboxylic acid methyl ester
9alpha-Acetoxymelnerin A		 85.71
C00034349 Youngiaside A 85.71
C00045940 Ferupennin I
(+)-Ferupennin I		 85.48
C00011854 Acanthoglabrolide 85.25
C00011855 Acanthospermal B 85.25
C00012146 3-O-Methyltithonin 85.25
C00012273 Linearilobin C 85.25
C00020500 Eupachifolin C 85.25
C00020764 Diaspanoside B 85.25
C00020803 Ixerisoside D
(-)-Ixerisoside D		 85.25
C00043356 Caseamembrin F
(+)-Caseamembrin F		 85.25
C00045942 Ferupennin K
(-)-Ferupennin K		 85.25
C00045945 Ferupennin N
(+)-Ferupennin N		 85.25
C00048105 Sculponeatin D 85.25
C00049591 Neurolenin H 85.25
C00003322 Melampodin A 84.13
C00020501 Eupachifolin B 84.13
C00020532 Crepidiaside C 84.13
C00003078 Didrovaltratum 83.87
C00010581 Isovaltrate 83.87
C00020879 8-Acetylpumilin
8-O-Acetyl pumilin		 83.87
C00035517 Adenolin B 83.87
C00045943 Ferupennin L
(+)-Ferupennin L		 83.87
C00003267 Eupacunolin 83.61
C00011771 (-)-Ursanthemolide
Ursanthemolide		 83.61
C00011861 (3aR,4R,6E,10E,11aR)-10-[(Acetyloxy)methyl]-6-formyl-2,3,3a,4,5,8,9,11a-octahydro-3-methylene-2-oxocyclodeca[b]furan-4-yl ester 2-methylbutanoic acid 83.61
C00012062 (+)-Zempoalin D
Zempoalin D		 83.61
C00012224 Eurecurvin 83.61
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 83.61
C00020527 8beta-Hydroxy-9beta-(5-acetoxy-tiglinoyloxy)-lasiolaenin 83.61
C00022673 8beta-Acetoxy-3beta-angeloyloxy-5alpha-hydroxycostic acid methyl ester 83.61
C00033975 Ixerin V 83.61
C00035783 15-O-Isovaleroyl-3beta-O-acetyl-2alpha-hydroxyamphoricarpolide 83.61
C00036545 3-Epiphlomurin
(-)-3-Epiphlomurin		 83.61
C00036703 Alatoside C
(-)-Alatoside C(Laggera alata)		 83.61
C00036704 Alatoside D
(-)-Alatoside D		 83.61
C00037618 Phlomurin
(+)-Phlomurin		 83.61
C00041391 Briarellin R 83.61
C00044376 Vilmorinine B
(+)-Vilmorinine B		 83.61
C00045941 Ferupennin J
(+)-Ferupennin J		 83.61
C00011833 Isouvedalin 83.33
C00012287 Melcanthin A 83.08
C00012290 Melcanthin F 83.08
C00020694 Zoapatanolide C 83.08
C00029954 Cichorioside H 83.08
Page Top