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


and

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





INPUT WORD = C00039748 , 50% or more
[ Metabolite Name : Membrenone B , (+)-Membrenone B ]
Number of matched data : 55

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00039747 Membrenone A
(+)-Membrenone A
92.59
C00039770 Micromelone B
(+)-Micromelone B
88.00
C00003339 Nobilin 86.27
C00017785 Neorustmicin C 86.00
C00022492 3-Oxo-18-hydroxy-8(17),13Z-labdadien-15-oic acid 86.00
C00031557 Acanthokoreoic acid A 86.00
C00044990 Pachyclavulariolide N
(-)-Pachyclavulariolide N
86.00
C00044991 Pachyclavulariolide O
(-)-Pachyclavulariolide O
86.00
C00048756 Lobophytolide D
(-)-Lobophytolide D
86.00
C00000053 Gibberellin A53
GA53
84.91
C00023191 8beta-Tigloyloxy-3beta,14-dihydroxy-6betaH,7alphaH-germacra-1(10)Z,4E-11(13)-trien-6,12-olide 84.91
C00011887 Tagitinin D
Tirotundin
84.62
C00012979 Chapinolin
[3aR-[3aalpha,4alpha(Z),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid
84.62
C00012983 Arturin
[3aR-[3aalpha,4beta(Z),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid
84.62
C00017311 [4S-[4alpha(E),4aalpha,5beta,8aalpha]]-4,4a,5,6,7,8,8a,9-Octahydro-5-hydroxy-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-2-butenoic acid 84.62
C00021164 Isochiapin B 84.62
C00038325 7R-Hydroxy-14-deoxyandrographolide 84.62
C00038326 7S-Hydroxy-14-deoxyandrographolide 84.62
C00049585 Sarcotol acetate 84.62
C00011800 3-Dehydronobilin 84.31
C00011848 1(10)E-Millerenolide 84.31
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 84.31
C00017379 [1aR-(1aalpha,3alpha,4beta,4abeta,5beta,9aS*)]- 1a,2,4,4a,5,9-Hexahydro-5-hydroxy-4,4a,6-trimethyl-3H-oxireno[8,8a]naphtho[2,3-b]furan-3-yl ester 2-methyl-2-propenoic acid 84.31
C00022666 3beta-Angeloyloxyisocostic acid methyl ester 84.31
C00038400 Alboatisin C
(-)-Alboatisin C
84.31
C00003187 Shiromodiol diacetate 84.00
C00003446 Jatrophone 84.00
C00003450 Lathyrol 84.00
C00003457 Montanol 84.00
C00012905 [4aR-(4aalpha,5alpha,6alpha,8abeta)]-4,4a,5,6,7,8,8a,9-Octahydro-5-hydroxy-3,5,8a-trimethylnaphtho[2,3-b]furan-6-yl ester3-methylbutanoic acid 84.00
C00013084 [5aR-(5aalpha,6alpha,8alpha,9beta,9abeta,9balpha)]-8-(Acetyloxy)-5,5a,6,7,8,9,9a,9b-octahydro-6,9-dihydroxy-3-(hydroxymethyl)-5a,9-dimethylnaphtho[1,2-b]furan-2(4H)-one 84.00
C00013088 [5aR-(5aalpha,6alpha,8alpha,9abeta,9balpha)]-8-(Acetyloxy)-5,5a,6,7,8,9,9a,9b-octahydro-6-hydroxy-3-(hydroxymethyl)-5a-methyl-9-methylenenaphtho[1,2-b]furan-2(4H)-one 84.00
C00017354 [4aR-[4aalpha,5alpha,6alpha(Z),8aalpha,9alpha]]-4,4a,5,6,7,8,8a,9-Octahydro-9-hydroxy-3,4a,5-trimethylnaphtho[2,3-b]furan-6-yl ester 2-methyl-2-butenoic acid 84.00
C00017786 Neorustmicin D 84.00
C00018475 (-)-Ebelactone A
Ebelactone A
NSC 335650
84.00
C00018476 (-)-Ebelactone B
Ebelactone B
NSC 335651
84.00
C00020511 Aguerin A 84.00
C00020512 Aguerin B 84.00
C00021058 Desacetylgaillardipinnatin 84.00
C00021807 5alpha-Angeloyloxy-11beta-hydroxysilphinen-3-one 84.00
C00022141 Albocycline M-5 84.00
C00022144 Albocycline M-3 84.00
C00022159 Tomentol 84.00
C00022232 14-Deoxyandrographolide 84.00
C00022240 14-Deoxy-11,14-didehydroandrographolide 84.00
C00022246 Cordobic acid 84.00
C00022248 7-Epicordobic acid 84.00
C00022286 ent-9alpha,13R-Epoxy-18-hydroxy-14-labden-7-one 84.00
C00022354 Epijabugotriol 84.00
C00023278 3alpha-Acetoxybiformene 84.00
C00023331 3beta-Methoxy-8-labdene-7beta,15-diol 84.00
C00033595 8alpha-Isobutyryloxydouglanin 84.00
C00033908 Henrilabdane B
(-)-Henrilabdane B
84.00
C00049965 8beta-Isobutyryloxycumambranolide
(-)-8beta-Isobutyryloxycumambranolide
84.00
C00050374 Leopersin G
(+)-Leopersin G
84.00
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