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


and

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




INPUT WORD = C00012751 , 50% or more
[ Metabolite Name : Coralloidin A , [2R-(2alpha,5beta,8aalpha)]-1,2,3,5,6,7,8,8a-Octahydro-5,8a-dimethyl-3-(1-methylethylidene)-2-naphthalenol acetate ]
Number of matched data : 107

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012752 (-)-Coralloidin C
Coralloidin C
(1R-trans)-1,3,4,5,6,7-Hexahydro-1-methyl-7-(1-methylethylidene)-4a(2H)-naphthalenemethanol acetate		 94.87
C00011560 Onchidal 90.00
C00012001 8-Acetoxyelemol
8alpha-Acetoxyelemol		 90.00
C00011429 (+)-9-Acetoxynerolidol 89.74
C00011725 [1S-(1R*,5E,7R*)]-4,10-bis(methylene)-7-(1-methylethyl)-5-Cyclodecen-1-ol acetate 89.74
C00021574 Norbotryal acetate 89.74
C00022180 Dinortrixagone 89.74
C00012784 [1R-(1alpha,2beta,4abeta,8aalpha)]-1-(Acetyloxy)decahydro-alpha,alpha,4a-trimethyl-8-methylene-2-naphthalenemethanol 87.80
C00017513 Fauronyl acetate 87.80
C00021281 (-)-Cyperenyl acetate 87.50
C00029918 Cedryl acetate
8betaH-Cedran-8-ol acetate		 87.50
C00037484 Marsupellol acetate
(-)-Marsupellol acetate		 87.50
C00046940 Suberosenol A acetate
(-)-Suberosenol A acetate		 87.50
C00046942 Suberosenol B acetate
(-)-Suberosenol B acetate		 87.50
C00012735 [1S-(1alpha,2beta,4abeta,8aalpha)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-2-(1-methylethenyl)-1-naphthalenol acetate 87.18
C00012887 Asterolide
Atractylenolide II
[4aS-(4aalpha,8abeta,9abeta)]-4a,5,6,7,8,8a,9,9a-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 87.18
C00012888 8-Epiasterolide
[4aS-(4aalpha,8abeta,9aalpha)]-4a,5,6,7,8,8a,9,9a-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 87.18
C00012892 Neoalantolactone 87.18
C00012895 2alpha-Hydroxy alantolactone 87.18
C00012896 2-Oxoalantolactone
[3aR-(3aalpha,5beta,8abeta,9aalpha)]-3,3a,5,6,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2,7-dione		 87.18
C00012921 8beta-Hydroxyasterolide
Atractylenolide III
Codonolactone
[4aS-(4aalpha,8abeta,9abeta)]-4a,5,6,7,8,8a,9,9a-Octahydro-9a-hydroxy-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 87.18
C00013580 Chloranthalactone D
4a,5,5a,6,6a,6b,7,7a-Octahydro-7a-hydroxy-3,6b-dimethyl-5-methylenecycloprop[2,3]indeno[5,6-b]furan-2(4H)-one		 87.18
C00020358 4-O-Methylzedoarondiol 87.18
C00023427 (-)-Sclareolide
ent-Norambreinolide		 87.18
C00029349 (Z)-alpha-trans-Bergamotol acetate
trans-.alpha-Bergamotyl acetate		 87.18
C00030247 Farnesyl acetate 87.18
C00030877 Occidentalol acetate 87.18
C00031471 (E,E)-Farnesyl acetate 87.18
C00041642 Mairetolide A
(-)-Mairetolide A		 87.18
C00044955 Neolitacumone B
(+)-Neolitacumone B		 87.18
C00011432 [3R-(3R*,5S*,6E,9S*)]-3,7,11-trimethyl-1,6,10-dodecatriene-3,5,9-triol 9-acetate 85.37
C00017013 [1R-(1alpha,4aalpha,5alpha)]- 1-(Acetyloxy)-3,4,4a,5,6,7-hexahydro-4a,5-dimethyl-3-(1-methylethylidene)-2(1H)-naphthalenone 85.37
C00020406 11-Acetoxy-10(14)-guaien-4alpha-ol 85.37
C00027830 Alolycopine 85.37
C00027861 Anhydroaposerratinine 85.37
C00033143 Madolin H
(-)-Madolin H		 85.37
C00011702 [1S-(1R*,4S*,5E,7R*)]-4-Methyl-10-methylene-7-(1-methylethyl)-1-acetate 5-cyclodecene-1,4-diol 85.00
C00012909 [3S-(3alpha,3abeta,4abeta,8aalpha,9abeta)]-Decahydro-3a-hydroperoxy-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one 85.00
C00020780 5alpha,8beta-Dihydroxyeudesma-4(15),7(11)-diene-8,12-olide 85.00
C00021106 10alpha-Chloro-1beta-hydroxyeremophil-11(13)-en-12,8beta-olide 85.00
C00022202 Trixagoene 85.00
C00023426 3alpha-Hydroxynorambreinolid 85.00
C00023430 Ambreinolide 85.00
C00029916 Cedr-8(15)-en-9-alpha-ol acetate 85.00
C00040764 12-Acetoxyisocomene
(-)-12-Acetoxyisocomene		 85.00
C00044954 Neolitacumone A 85.00
C00003306 Isoalantolactone
Isoallantolactone
Isohelenin		 84.62
C00003310 Ivalin
[3aR-(3aalpha,4aalpha,7alpha,8abeta,9aalpha)]-Decahydro-7-hydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one		 84.62
C00007426 Heptadecanoic acid
Margaric acid		 84.62
C00012019 Isogermafurenolide 84.62
C00012036 Hydroxyisogermafurenolide 84.62
C00012426 Coralloidin B 84.62
C00012531 (-)-Tochuinyl acetate
Tochuinol acetate
Tochuinyl acetate		 84.62
C00012532 (1R,2R)-1,2-Dimethyl-2-(4-methyl-1,4-cyclohexadien-1-yl)cyclopentanemethanol acetate
Dihydrotochuinyl acetate		 84.62
C00012729 [2R-(2alpha,3alpha,4alpha,4aalpha,8abeta)]-Decahydro-3,4-dihydroxy-4a-methyl-alpha,8-bis(methylene)-2-naphthaleneacetic acid
8beta,9beta-Dihydroxycostic acid		 84.62
C00012821 (1alpha,2beta,4aalpha,8aalpha)-N-[Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenyl]-formamide 84.62
C00012827 [3R-(3alpha,4abeta,7beta)]-2,3,4,4a,5,6,7,8-Octahydro-3-hydroxy-4a-methyl-7-(1-methylethenyl)-1-naphthalenecarboxaldehyde 84.62
C00012837 Quadrangulin A
[1S-(1alpha,2beta,4abeta,8aalpha)]-Decahydro-1-hydroxy-4a-methyl-alpha,8-bis(methylene)-2-naphthaleneacetic acid methyl ester		 84.62
C00012878 [3R-(3alpha,3aalpha,4abeta,8aalpha,9aalpha)]-Decahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one
Dihydroallitrisin		 84.62
C00012893 (+)-Alantolactone
Alant camphor
Elecampane camphor
Eupatal
Inula camphor
Alantolactone		 84.62
C00012894 1beta-Hydroxyalantolactone
[3aR-(3aalpha,5beta,8beta,8abeta,9aalpha)]-3a,5,6,7,8,8a,9,9a-Octahydro-8-hydroxy-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 84.62
C00012914 Septuplinolide
[3aR-(3aalpha,4aalpha,5beta,8abeta,9aalpha)]-Decahydro-5-hydroxy-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 84.62
C00012916 Telekin
Telekine
[3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-Decahydro-4a-hydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one		 84.62
C00012918 5-Epitelekin
[3aR-(3aalpha,4abeta,8abeta,9aalpha)]-Decahydro-4a-hydroxy-8a-methyl-3,5-bis(methylene)-naphtho[2,3-b]furan-2(3H)-one		 84.62
C00012946 [4aS-(4aalpha,5alpha,8abeta,9abeta)]-4a,6,7,8a,9,9a-Hexahydro-3,5,8a-trimethylnaphtho[2,3-b]furan-2,8(4H,5H)-dione 84.62
C00013548 Axamide 4
N-[2-Methyl-1-[(1R,3aR,7aR)-octahydro-3a-methyl-7-methylene-1H-inden-1-yl]-1-propenyl]-formamide		 84.62
C00013571 Crispatanolide
(3R,4aS,4bR,5aR,6aR)-Hexahydro-4b-methyl-3-(1-methylethyl)-3H-3,6a-ethano-1H-cyclopropa[3,4]cyclopenta[1,2-c]pyran-1-one		 84.62
C00013574 13-Deoxyisoonoceriolide
[3aR-(3aalpha,4abeta,5abeta,6abeta,6balpha,7aalpha)]-Decahydro-6b-methyl-3,5-bis(methylene)cycloprop[2,3]indeno[5,6-b]furan-2(3H)-one		 84.62
C00013575 [3aS-(3aalpha,4alpha,4aalpha,5aalpha,6aalpha,6bbeta,7abeta)]-Decahydro-4-hydroxy-6b-methyl-3,5-bis(methylene)cycloprop[2,3]indeno[5,6-b]furan-2(3H)-one 84.62
C00013579 Geigeranolide
(3aR,4aR,4bR,5aR,6aR,7aR)-Decahydro-4b,6a-dimethyl-3-methylenecycloprop[1,2]indeno[5,6-b]furan-2(3H)-one		 84.62
C00013582 11beta,13-Dihydrogeigeranolode
[3R-(3alpha,3aalpha,4aalpha,4bbeta,5abeta,6abeta,7aalpha)]-Decahydro-3,4b,6a-trimethylcycloprop[1,2]indeno[5,6-b]furan-2(3H)-one		 84.62
C00013586 Linderoxide
(4aS,5aS,6aR,6bS)-4,4a,5,5a,6,6a,6b,7-Octahydro-3-(methoxymethyl)-6b-methyl-5-methylenecycloprop[2,3]indeno[5,6-b]furan		 84.62
C00016961 Shizukanolide
Shizukanolide A		 84.62
C00016962 Shizukanolide B
Chloranthalactone A		 84.62
C00017336 Tetrahydroligularenolide 84.62
C00017438 Istanbulin C 84.62
C00020143 Pernetic acid A methyl ester 84.62
C00020613 4,5-Epoxyosmitopsin 84.62
C00021013 5,10-bis-epi-Isoalantolactone 84.62
C00021088 5-Acetoxynerolidol 84.62
C00021101 [3aR-(3aalpha,6alpha,8abeta,9aalpha)]-3a,4,6,7,8,8a,9,9a-Octahydro-6-hydroxy-5,8a-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one 84.62
C00021103 1beta,10beta-Epoxyeremophil-11(13)-en-12,8beta-olide 84.62
C00021419 Hercynolactone
Fastigiolide		 84.62
C00022075 Neophytadiene 84.62
C00022076 Tetramethylhexadecane 84.62
C00022152 [R-(E,E)]-13-Hydroxy-6,10,14-trimethyl-5,9,14-pentadecatrien-2-one 84.62
C00022161 (E,E)-6,10,14-Trimethyl-5,9-pentadecadiene-2,12-dione 84.62
C00022162 (Z,E)-6,10,14-Trimethyl-5,10-pentadecadiene-2,12-dione 84.62
C00023387 15,16-Dinor-8(17),11E-labdadien-13-one 84.62
C00029815 beta-Eleostearic acid
.psi-Eleostearic acid		 84.62
C00030065 Curcumenolactone A
(+)-Curcumenolactone A		 84.62
C00030066 Curcumenolactone B
(-)-Curcumenolactone B		 84.62
C00030480 6,10,14-Trimethyl-2-pentadecanone
Hexahydrofarnesyl acetone
6,10,14-Trimethylpentadecan-2-one
Perhydrofarnesyl acetone
Hexahydrofarnesy acetone		 84.62
C00035945 4(15)-Aromadendren-12,5alpha-olide
(+)-4(15)-Aromadendren-12,5alpha-olide		 84.62
C00036669 9,12-Octadecadienoic acid 84.62
C00038337 9alpha-Hydroxyasterolide 84.62
C00039369 Henridilactone B 84.62
C00044036 (11S)-Jalapinolic acid 84.62
C00045508 11alpha,13-Dihydroalantolactone
(-)-11alpha,13-Dihydroalantolactone		 84.62
C00046251 Oropheic acid 84.62
C00046478 Tubipolide D
(-)-Tubipolide D		 84.62
C00046489 Ulosin A 84.62
C00047334 Phytone
(+)-Phytone		 84.62
C00047667 4-Acetoxy-5-brasilene 84.62
C00048281 3,7,11,15-Tetramethylhexadec-1-ene
Phytene 1		 84.62
C00048497 Nor-ambreinolide
(+)-Nor-ambreinolide		 84.62
C00050320 3-Acetoxy-E-gamma-Bisabolene 84.62
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