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


and

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




INPUT WORD = C00042660 , 50% or more
[ Metabolite Name : Laevinone A , (+)-Laevinone A ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00021913 4-Acetoxy-10-hydroxy-2,8-neolemnadien-5-one 97.67
C00030924 Paralemnolin D
(+)-Paralemnolin D		 95.35
C00030927 Paralemnolin G
(+)-Paralemnolin G		 90.91
C00021018 3beta-Acetoxy-desoxo-achalensolide 86.36
C00016986 12-Acetoxyeremophilene
[2R-(2alpha,8alpha,8aalpha)]-1,2,3,4,6,7,8,8a-octahydro-8,8a-dimethyl-beta-methylene-2-naphthaleneethanol acetate		 86.05
C00039825 Nardosinanol D
(-)-Nardosinanol D		 86.05
C00021914 4,10-Diacetoxy-2,8-neolemnadien-5-one 85.71
C00030925 Paralemnolin E
(+)-Paralemnolin E		 85.11
C00003104 Botrydial 84.44
C00020744 [1R-(1alpha,4abeta,6alpha,8aalpha)]-6-(Acetyloxy)-1,2,4a,5,6,8a-hexahydro-4,7-dimethyl-a-methylene-1-naphthaleneacetic acid methyl ester 84.44
C00020749 [1R-(1alpha,4aalpha,6alpha,8aalpha)]-6-(Acetyloxy)-1,2,4a,5,6,8a-hexahydro-4,7-dimethyl-a-methylene-1-naphthaleneacetic acid methyl ester 84.44
C00020917 3beta-Acetoxy-5,11(13)-guaiadien-12,8alpha-olide 84.09
C00021352 9-Acetoxyfukinanolide 84.09
C00021695 Acetylivalin 84.09
C00021792 8beta-Acetoxy-9(12)-capnellene-5alpha,10alpha-diol 84.09
C00000484 Laurencin 83.72
C00001214 9,10-Dihydroxystearic acid 83.72
C00012198 Herbolide A 83.72
C00012387 [3aR-(3aR*,5Z,9E,11aS*)]-6-[(Acetyloxy)methyl]-3a,4,7,8,11,11a-hexahydro-10-methyl-3-methylenecyclodeca[b]furan-2(3H)-one 83.72
C00012699 [4aR-(4aalpha,5alpha,6beta,8abeta)]-5-(Acetyloxy)-4a,5,6,7,8,8a-hexahydro-6-(1-hydroxy-1-methylethyl)-4,8a-dimethyl-2(1H)-naphthalenone 83.72
C00012774 [1R-(1alpha,4abeta,7beta,8alpha,8aalpha)]-Decahydro-7-(1-hydroxy-1-methylethyl)-1,4a-dimethyl-1,8-naphthalenediol 1-acetate 83.72
C00017013 [1R-(1alpha,4aalpha,5alpha)]- 1-(Acetyloxy)-3,4,4a,5,6,7-hexahydro-4a,5-dimethyl-3-(1-methylethylidene)-2(1H)-naphthalenone 83.72
C00020355 6beta-Acetoxy-1beta-hydroxy-4,11-guaiadien-3-one 83.72
C00020363 Liguloxidol acetate 83.72
C00021894 4alpha-Hydroxygymnomitryl acetate 83.72
C00029308 (10E,12E)-9,14-Dioxo-10,12-octadecadienoic acid 83.72
C00031076 Porrigenic acid
(-)-Porrigenic acid		 83.72
C00032980 Ficusolide diacetate 83.72
C00044535 Armatin C
(-)-Armatin C		 83.72
C00044536 Armatin D
(-)-Armatin D		 83.72
C00044537 Armatin E
(-)-Armatin E		 83.72
C00048361 Corchorifatty acid B 83.72
C00050152 Madolin D
(+)-Madolin D		 83.72
C00030928 Paralemnolin H
(-)-Paralemnolin H		 82.98
C00013002 Torrentin
[3S-(3alpha,3aalpha,5abeta,6beta,8beta,9bbeta)]-8-(Acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-6-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 82.61
C00013074 8alpha-Acetoxytaurin
(3S,3aS,5aR,8R,9bS)-8-(Acetyloxy)-3a,5,5a,7,8,9b-hexahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,6(3H,4H)-dione		 82.61
C00021786 8beta-Acetoxy-9(12)-capnellene-8beta,10alpha,14-triol 82.61
C00003395 Xanthumin 82.22
C00011755 Herbolide D 82.22
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		 82.22
C00012495 Naematolon
Nematolone		 82.22
C00030486 Hiyodorilactone C 82.22
C00044460 5alpha-Androst-1-ene-3beta,17beta-diol 82.22
C00000390 12S,13S-Epoxy-9S-hydroxy-10E,15Z-octadecadienoic acid 81.82
C00000404 12,13-trans-Epoxy-9-oxo-10E,15Z-octadecadienoic acid 81.82
C00013043 [3aS-(3aalpha,5abeta,7alpha,9balpha)]-7-(Acetyloxy)-3a,4,5,5a,6,7,8,9b-octahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
2alpha-Acetoxysphaerantholide		 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
C00020997 [3aR-(3aalpha,4aalpha,6beta,7aalpha,9abeta)]-6-(Acetyloxy)decahydro-3,5,8-tris(methylene)-azuleno[6,5-b]furan-2(3H)-one 81.82
C00031486 1,3-Di-O-[2',2'-di-(p-phenylene) isopropylidene] glycerol
Vernoniether S		 81.82
C00041808 Russujaponol B
(-)-Russujaponol B		 81.82
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