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


and

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




INPUT WORD = C00046557 , 50% or more
[ Metabolite Name : 12-Hydroxydehydrobotrydienol , (+)-12-Hydroxydehydrobotrydienol ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00046551 11-Hydroxydehydrobotrydienol
(-)-11-Hydroxydehydrobotrydienol		 97.30
C00021655 7-Hydroxy-10-oxodehydrodihydrobotrydial 94.74
C00021656 7,10-Dihydroxydehydrodihydrobotrydial 94.74
C00021571 Dehydrobotrydienal 94.59
C00045507 10-Oxodehydrodihydrobotrydial
(+)-10-Oxodehydrodihydrobotrydial		 94.59
C00046716 Dehydrobotrydienol
(-)-Dehydrobotrydienol		 94.59
C00010844 7-Isobutyryloxythymol methyl ether 89.19
C00020185 (1S,4S)-7-Methoxycalamenen-3-one 89.19
C00020773 (1S,4R)-7-Methoxycalamenen-4-ol 89.19
C00021659 7-Hydroxy-10-dehydroxydehydrodihydrobotrydial 89.19
C00046122 Mansonone P
(-)-Mansonone P		 89.19
C00020075 5-Hydroxy-8-methoxycalamenene 86.49
C00020183 Methyl 3,4-dihydro-5-methyl-8-isopropyl-2-naphthalenecarboxylate 86.49
C00021111 2-[4-Methyl-2-(2-methylpropoxy)phenyl]-oxiranemethanol 86.49
C00021570 Botrydienal 86.49
C00023717 Pyriculariol 86.49
C00036014 4'-Methoxycinnamyl isovalerate 86.49
C00037241 Heliannuol D
(+)-Heliannuol D		 86.49
C00037244 Heliannuol G
(-)-Heliannuol G		 86.49
C00021658 7-Hydroxy-10-ethoxydehydrodihydrobotrydial 85.71
C00021657 7-Hydroxy-10-methoxydehydrodihydrobotrydial 85.00
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
C00020124 Mansonone G methyl ether
5-Isopropyl-6-methoxy-3,8-dimethyl-1,2-naphthoquinone		 84.62
C00040668 Wutaiensal 84.62
C00045890 Enokipodin D
(+)-Enokipodin D		 84.62
C00012042 3abeta,4,5,8bbeta-tetrahydro-3alpha,4alpha,8-trimethyl-4-vinylbenzo[1,2-b:3,4-b']difuran-2(3H)-one
Dihydroisolinderalactone		 84.21
C00012553 Aplysinol
[3S-(3alpha,3abeta,8bbeta)]-7-Bromo-1,2,3,8b-tetrahydro-3,6,8b-trimethyl-3aH-cyclopenta[b]benzofuran-3a-methanol		 84.21
C00012554 [3S-(3alpha,3abeta,8bbeta)]-7-Bromo-1,2,3,8b-tetrahydro-3,6,8b-trimethyl-3aH-cyclopenta[b]benzofuran-3a-carboxaldehyde
Aplysinal		 84.21
C00020119 Mansonon D
Mansonone D		 84.21
C00020121 Mansonone E 84.21
C00037249 Helibisabonol A
(-)-Helibisabonol A		 84.21
C00037250 Helibisabonol B 84.21
C00011576 Trisporone 83.78
C00011953 Methyl nidorellaurinate 83.78
C00012555 Isoaplysin
[3S-(3alpha,3abeta,8bbeta)]-3a-(Bromomethyl)-2,3,3a,8b-tetrahydro-3,6,8b-trimethyl-1H-cyclopenta[b]benzofuran		 83.78
C00012564 (+)-2-(Bromomethyl)-2,3,4,5-tetrahydro-5,8,10-trimethyl-2,5-methano-1-benzoxepin 83.78
C00019813 Citrubuntin 83.78
C00020175 3-Methoxy-8-calamenenol
(1S,3R,4R)-7-Methoxycalamenen-3-ol		 83.78
C00020179 3-Methoxy-8-calamenenone
(1S,4R)-7-Methoxycalamenen-3-one		 83.78
C00030731 Mansorin A
Mansonrin A		 83.78
C00031122 Radicamine A
(+)-Radicamine A		 83.78
C00037240 Heliannuol C
(-)-Heliannuol C		 83.78
C00037245 Heliannuol H
(-)-Heliannuol H		 83.78
C00042034 10-epi-7,10-epoxy-ar-bisabol-11-ol 83.78
C00042167 7,10-Epoxy-ar-bisabol-11-ol 83.78
C00042680 Laur-11-en-1,10-diol
(-)-Laur-11-en-1,10-diol		 83.78
C00046922 Secobotrytriendiol
(+)-Secobotrytriendiol		 83.78
C00021113 2-[4-Methyl-2-(2-methylpropoxy)phenyl]-oxiranemethanol acetate 82.93
C00002995 Heritonin 82.50
C00010815 7-Isobutyryloxythymohydroquinone dimethyl ether 82.50
C00016498 NFAT 133 82.50
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