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


and

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





INPUT WORD = C00042867 , 50% or more
[ Metabolite Name : Pseudopyronine A ]
Number of matched data : 69

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00016851 KDC 165
Resorstatin
92.11
C00015217 Pseudopyronine B 90.48
C00046157 Minquartynoic acid
(-)-Minquartynoic acid
85.37
C00013588 Lumiyomogin
(3aR,3bS,4aR,7aR,8aS)-3a,3b,4,4a,7a,8-Hexahydro-3a,3b-dimethyl-7-methylene-3H-cyclopenta[1,3]cyclopropa[1,2-f]benzofuran-3,6(7H)-dione
84.62
C00039248 Gallicynoic acid C
(+)-Gallicynoic acid C
84.62
C00039252 Gallicynoic acid H
(-)-Gallicynoic acid H
84.62
C00000362 OPC-6:0 84.21
C00001234 Palmitoleic acid
(Z)-Palmitoleic acid
cis-Palmitoleic acid
84.21
C00002239 (-)-Tinctorine
Tinctorine
84.21
C00003210 Ambrosin 84.21
C00003244 Damsin 84.21
C00012021 15-Hydroxyelemasteriactinolide 84.21
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 84.21
C00016962 Shizukanolide B
Chloranthalactone A
84.21
C00017439 2-Oxo-eremophila-1(10),11(13)-dien-12,8beta-olide 84.21
C00020925 [3aR-(3aalpha,5alpha,7aalpha,8alpha,9abeta)]-3a,5,6,7,7a,8,9,9a-Octahydro-5-hydroxy-5,8-dimethyl-3-methylene-azuleno[6,5-b]furan-2(3H)-one 84.21
C00026337 Isotinctorine 84.21
C00029354 CID is old! 84.21
C00031839 Gymnasterkoreayne F
(+)-Gymnasterkoreayne F
84.21
C00044036 (11S)-Jalapinolic acid 84.21
C00049696 3-Methoxy-3-epiradicinol
(-)-3-Methoxy-3-epiradicinol
84.21
C00038237 3,4-Dihydro-1,2-secomicrominutinin 82.50
C00002235 Sophoramine 82.05
C00007435 9-Octadecene-1,18-diol 82.05
C00007440 10,16-Dihydroxy-hexadecanoate
10,16-Dihydroxypalmitic acid
82.05
C00016271 (+)-Harziphilone
Harziphilone
82.05
C00031840 Gymnasterkoreayne G
(+)-Gymnasterkoreayne G
82.05
C00000442 8S-Hydroxyhexadecanoic acid 81.58
C00001233 Palmitic acid
n-Hexadecanoic acid
Hexadecanoic acid
81.58
C00001277 Cicutoxin 81.58
C00001283 Falcarindiol 81.58
C00007430 16-Hydroxy-hexadecanoic acid 81.58
C00007436 1,7,16-Hexadecanetriol 81.58
C00007729 11alpha-Allylcytisine 81.58
C00011389 5-(4-Hydroxy-2-methyl-2-butenyl)-3-(4-methyl-5-oxo-3-pentenyl)-2(4H)-furanone
(E,E)-5-[2,5-Dihydro-5-(4-hydroxy-2-methyl-2-butenyl)-2-oxo-3-furanyl]-2-methyl-2-pentenal
81.58
C00012022 [3R-(3alpha,3aalpha,5alpha,6beta,7aalpha)]-6-Ethenylhexahydro-5-[1-(hydroxymethyl)ethenyl]-3,6-dimethyl-(3H)-benzofuranone 81.58
C00012035 Shonachalin D 81.58
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
81.58
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
81.58
C00012889 Atractylenolide I
(4aS-trans)- 4a,5,6,7,8,8a-hexahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one
81.58
C00012911 Ivangustin 81.58
C00012913 (+)-Isotelekin
Isotelekin
81.58
C00016532 Sorrentanone 81.58
C00016697 Cheimonophyllon D 81.58
C00017328 2alpha-Hydroxyxanthanodiene
[3aR-(3aalpha,4abeta,5beta,7alpha,9aalpha)]-3a,4,4a,5,6,7,9,9a-Octahydro-7-hydroxy-4a,5-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one
81.58
C00017329 3beta-Hydroxyxanthanodiene
[3aR-(3aalpha,4abeta,5beta,6beta,9aalpha)]-3a,4,4a,5,6,7,9,9a-octahydro-6-hydroxy-4a,5-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one
81.58
C00017330 3-Oxoxanthanodiene
[3aR-(3aalpha,4abeta,5beta,9aalpha)]-3a,4a,5,7,9,9a-Hexahydro-4a,5-dimethyl-3-methylene-naphtho[2,3-b]furan-2,6(3H,4H)-dione
81.58
C00017501 Calcalal 81.58
C00017571 Resorthiomycin 81.58
C00018069 2-Hexyl-5-propylresorcinol
Antibiotic DB 2073
81.58
C00020075 5-Hydroxy-8-methoxycalamenene 81.58
C00020297 Fragrolide 81.58
C00020346 Carabrone
Caropesia lactone
81.58
C00020347 Carabrol
4-Dihydrocarabrone
81.58
C00029488 3beta-Chlorodehydrocostuslactone 81.58
C00030403 Ginsenoyne E 81.58
C00030479 CID is old! 81.58
C00032218 Subamolide E
(+)-Subamolide E
81.58
C00033643 Annuolide D 81.58
C00034997 16-Hydroxyhexadecanoic acid 81.58
C00036689 Acutifolone B 81.58
C00039247 Gallicynoic acid B 81.58
C00041228 (3R,8S)-Falcarindiol 81.58
C00042860 Poipuol 81.58
C00043016 Sohirnone C 81.58
C00045983 Gymnasterkoreayne B
(+)-Gymnasterkoreayne B
81.58
C00048294 5-Pentyl-3-methoxy-N-butylaniline 81.58
C00049281 Pterophyllin 1
(+)-Pterophyllin 1
81.58
C00049856 cis-Hexadec-11-en-7,9-diynoic acid 81.58
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