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


and

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




INPUT WORD = C00003138 , 50% or more
[ Metabolite Name : Guaiazulene ]
Number of matched data : 58

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00020360 Lactarazulene 100.00
C00020112 Cadalene
Cadalin
1,6-Dimethyl-4-isopropylnaphthalene		 96.77
C00037986 Vetivazulene
Elemazulene		 96.77
C00003159 Lactaroviloin 93.94
C00020420 11,12-Dihydrolactaroviolin
7-Isopropyl-4-methyl-1-azulenecarbaldehyde		 93.94
C00003114 Camazulene
Chamazulene		 93.55
C00020426 Dihydrolinderazulene 91.18
C00020045 15-Cadalenal
5-Methyl-8-(1-methylethyl)-naphthalenecarboxaldehyde		 90.91
C00020114 7-Methyl-4-(1-methylethyl)-1-naphthalenecarboxaldehyde 90.91
C00020181 3,4-Dihydro-5-methyl-8-isopropyl-2-naphthalenecarboxaldehyde 90.91
C00038320 7-Hydroxycadalene 90.91
C00020170 Lacinilene A 90.32
C00041430 Chamazulene carboxylic acid 88.57
C00020169 6-Methoxy-7-methyl-1-(1-methylethyl)naphthalene 87.88
C00020198 Tetradehydrochromoarnottione 87.88
C00020067 alpha-Calacorene 87.10
C00020424 Lactarofulvene 87.10
C00035764 Tenuifolene
(-)-Tenuifolene		 87.10
C00020046 2,7-Dihydroxycadalene
3,9-Cadalenediol		 85.71
C00020425 Linderazulene 85.29
C00020070 gamma-Calacorene 83.87
C00020084 alpha-Corocalene 83.87
C00048328 beta-Calacorene 83.87
C00013240 Emmotin G
3-Hydroxy-a,a,5,8-tetramethyl-2-naphthalenemethanol		 82.86
C00020113 4,7-Dimethyl-2-(1-methylethyl)-1-naphthalenol 81.82
C00020403 Orobanone 81.82
C00021040 4-Formyl-1-methoxycarbonylazulene 81.82
C00020047 2-Hydroxy-7-methoxycadalene
9-Hydroxy-3-methoxycadalene		 81.08
C00020123 Mansonone G 81.08
C00020182 Methyl 5-methyl-8-isopropyl-2-naphthalenecarboxylate 81.08
C00011618 Iso-alpha-curcumene 80.65
C00012508 (+)-Cuparene
Cuparene
(R)-1-Methyl-4-(1,2,2-trimethylcyclopentyl)-benzene
(R)-Cuparene		 80.65
C00012510 (-)-Cuparene
(S)-1-Methyl-4-(1,2,2-trimethylcyclopentyl)benzene
(S)-(-)-Cuparene		 80.65
C00012529 gamma-Cuprenene
4-Cuprenene
Buprenene IV		 80.65
C00012541 (-)-Herbertene
(-)-Isocuparene
Herbertene
Isocuparene
(S)-1-Methyl-3-(1,2,2-trimethylcyclopentyl)benzene		 80.65
C00012569 (1R,2S)-(+)-p-(1,2-Dimethyl-3-methylenecyclopentyl)toluene
(+)-Laurene		 80.65
C00012575 (1R-cis)-1-(1,2-dimethyl-3-methylenecyclopentyl)-4-methyl-1,4-Cyclohexadiene
Isodihydrolaurene		 80.65
C00020072 (+)-Calamenene
(+)-cis-Calamenene		 80.65
C00020074 Calamenene
(-)-cis-Calamenene
L-Calamenene
(-)-Calamenene		 80.65
C00021038 5,6-Dihydrochamazulene 80.65
C00023229 Demethoxyencecalin 80.65
C00032554 Zonarene 80.65
C00036907 cis-Calamenene 80.65
C00037928 trans-Calamenene 80.65
C00049063 1,4-Dimethyl-azulene 80.65
C00002840 Mansonone C 80.00
C00020119 Mansonon D
Mansonone D		 78.95
C00020121 Mansonone E 78.95
C00002996 (+)-8-Hydroxycalamenene 78.79
C00012513 (S)-2,2,3-Trimethyl-3-(4-methylphenyl)cyclopentanone
Cyclopentanone, 2,2,3-trimethyl-3-p-tolyl-, (S)-(+)-
(+)-alpha-Cuparenone
(+)-Cuparenone
alpha-Cuparenone		 78.79
C00012516 (+)-beta-Cuparenone
beta-Cuparenone
beta-Cuparenone		 78.79
C00020068 3-Hydroxy-alpha-calacorene 78.79
C00020399 7-Dihydro-4-methyl-7-(1-methylethylidene)-1-azulenecarboxaldehyde 78.79
C00020400 Sangol 78.79
C00021949 Parvifolin 78.79
C00034980 (-)-7-Hydroxycalamenene 78.79
C00040139 R-(-)-alpha-Cuparenone
(-)-R-(-)-alpha-Cuparenone		 78.79
C00045270 Colpuchol 78.79
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