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


and

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




INPUT WORD = C00012076 , 50% or more
[ Metabolite Name : 2-Acetoxy-4,5-dihydroxykleinifulgin ]
Number of matched data : 55

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012077 5-Acetoxy-2,4-dihydroxykleinifulgin 98.85
C00012078 5-Acetoxy-11,13-epoxy-2,4-dihydroxykleinifulgin 95.56
C00012079 4,5-Dihydroxykleinifulgin 90.80
C00020716 Thapsivillosin K 87.78
C00034723 Thapsitranstagin 87.78
C00020715 Thapsigargicin 86.67
C00030337 Gagunin D 86.36
C00012065 [1R-[1R*,2S*(Z),4S*,6R*,8R*(Z),9S*,10S*(Z),11R*]]-1,6-Dimethyl-9-(1-methylethenyl)-7-oxo-5,12-dioxatricyclo[9.1.0.04,6]dodecane-2,8,10-triyl ester 2-methyl-2-butenoic acid 86.21
C00030568 Junceol F 86.21
C00030569 Junceol G 86.21
C00023196 3alpha-Angeloyloxy-2beta,15,16-trihydroxy-ent-labda-7,13E-dien-2-O-beta-[fucopyranoside-4'-O-acetate] 85.23
C00047570 Simplexin C
(+)-Simplexin C		 85.23
C00013147 [3R-(3alpha,4alpha,5alpha,5aalpha,6alpha,7alpha,9alpha,9aalpha,10R*)]-Octahydro-5a-(hydroxymethyl)-2,2,9-trimethyl-, 4,6,7,10-tetraacetate 5-benzoate 2H-3,9a-methano-1-benzoxepin-4,5,6,7,10-pentol 85.06
C00014880 Sch 484130 85.06
C00031937 Juncenolide B
(-)-Juncenolide B		 85.06
C00043212 5-epi-Canadensene 85.06
C00041193 Taxuspine L 84.78
C00050165 Mezzettiaside 11
(-)-Mezzettiaside 11		 84.62
C00039240 Gagunin M
(+)-Gagunin M		 84.44
C00040876 Areptin A 84.44
C00041902 Sylviside
(-)-Sylviside		 84.44
C00047572 Simplexin E
(+)-Simplexin E		 84.44
C00049841 Stecholide M 84.44
C00013128 Maytoline 84.27
C00041700 Nicandrose D
(+)-Nicandrose D		 84.27
C00041518 Florxenilide A
(+)-Florxenilide A		 84.09
C00042338 Caseamembrin D
(+)-Caseamembrin D		 84.09
C00043354 CID is old! 84.09
C00045700 Briaexcavatolide L
(-)-Briaexcavatolide L		 84.09
C00011883 Melampodinin B 83.91
C00013139 Maytine 83.91
C00013143 Ejap 12
[3R-(3alpha,4alpha,5alpha,5aalpha,6alpha,7alpha,9alpha,9aalpha,10R*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 5,7,10-triacetate 4-benzoate 2H-3,9a-methano-1-benzoxepin-4,5,6,7,10-pentol		 83.91
C00013166 [3R-(3alpha,5beta,5aalpha,6alpha,7alpha,9alpha,9aalpha,10R*)]-5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 6,7,10-triacetate 5-benzoate 2H-3,9a-methano-1-benzoxepin-5,6,7,10-tetrol 83.91
C00013175 Ejap 3
2[3R-(3alpha,4alpha,5beta,5aalpha,6alpha,9alpha,9aalpha,10R*)]- 5a-[(Acetyloxy)methyl]octahydro-2,2,9-trimethyl-H-3,9a-methano-1-benzoxepin-4,5,6,10-tetrol 4,6,10-triacetate 5-benzoate		 83.91
C00013176 Ejap 14
[3R-(3alpha,4alpha,5beta,5aalpha,6alpha,9alpha,9aalpha,10R*)]-4,6,10-tris(Acetyloxy)-5a-[(acetyloxy)methyl]octahydro-2,2,9-trimethyl-2H-3,9a-methano-1-benzoxepin-5-yl ester 3-pyridinecarboxylic acid		 83.91
C00030315 Forskoditerpenoside D
(-)-Forskoditerpenoside D		 83.91
C00030570 Junceol H 83.91
C00031586 Ajugamacrin B 83.91
C00039227 Frajunolide K
(+)-Frajunolide K		 83.91
C00040977 Glabcensin N
(-)-Glabcensin N		 83.91
C00041132 Taiwanxan 83.91
C00042903 Renillin A
(-)-Renillin A		 83.91
C00042904 Renillin B
(-)-Renillin B		 83.91
C00043524 Galphimine D
(-)-Galphimine D		 83.91
C00049346 20-Deacetyltaxachitriene A 83.91
C00049837 Stecholide I 83.91
C00031945 Juncin H
(+)-Juncin H		 83.52
C00047794 Chisonimbolinin D
(-)-Chisonimbolinin D		 83.52
C00016789 Antibiotic 5057A
Antibiotic X 14889B
Ferensimycin A		 83.33
C00018028 Lysocellin 83.33
C00024023 Verussurinine 83.33
C00027690 15-(2-Methylbutyroyl)germine 83.33
C00027692 15-Angeloylgermine 83.33
C00031406 Tasumatrol O
(-)-Tasumatrol O		 83.33
C00035076 Decipidone 83.33
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