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


and

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




INPUT WORD = C00037546 , 50% or more
[ Metabolite Name : Neopellitorine A ]
Number of matched data : 86

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00007423 Pentadecanoic acid
n-Pentadecanoic acid		 87.88
C00007542 Palmitaldehyde
1-Hexadecanal
Hexadecanal		 87.88
C00028813 N-Isobutyldeca-trans-2-trans-4-dienamide
Pellitorine		 87.88
C00030224 Ethyl tridecanoate 87.88
C00031306 Sarmentine 87.88
C00035616 Ethyl myristate 85.71
C00037269 Palmitic amide
Hexadecanamide		 85.71
C00049304 Sootepdienone
(+)-Sootepdienone		 85.71
C00050285 Hydroxycolorenone 85.71
C00037547 Neopellitorine B 85.29
C00003198 alpha-Vetivone 84.85
C00007424 cis-10-Pentadecenoic acid 84.85
C00015575 (2R-trans)-2-Butyl-5-heptyl-pyrrolidine
(-)-Solenopsis fugax venom		 84.85
C00016987 (+)-Nootkatone
Nootkanone
Nootkatone
4betaH,5alpha-Eremophila-1(10),11-dien-2-one		 84.85
C00016991 Alloeremophilone
3-Desoxyneopetasol
Eremophila-9,11-dien-8-one
Neopetasan		 84.85
C00020398 1beta,10betaH-Guaia-4,11-dien-3-one 84.85
C00021294 Valerenol 84.85
C00021295 Valerenal 84.85
C00021297 10-Epivalerenal 84.85
C00022791 1alpha,7alpha,10alphaH-Guaia-4,11(13)-dien-3-one 84.85
C00030959 Pentadecanal 84.85
C00035033 8-Hydroxy-pentadeca-(9E,13Z)-dien-11-yn-2-one 84.85
C00035547 Butyl caprate 84.85
C00040601 Undeca-2E,7Z,9E-trienoic acid isobutylamide
2E,7Z,9E-Undecatrienoic acid-N-isobutylamide		 84.85
C00049899 trans-Pentadec-10-en-6,8-diynoic acid 84.85
C00020905 [3R-(3alpha,3aalpha,4aalpha,9aalpha)]-3a,4,4a,7,9,9a-Hexahydro-3,5,8-trimethyl-azuleno[6,5-b]furan-2(3H)-one 83.33
C00020911 Ziniolide 83.33
C00020912 Xantholide A 83.33
C00020913 Xantholide B 83.33
C00021021 11beta,13-Dihydro-desoxo-achalensolide 83.33
C00031479 [(2E,4E)-Dodecadienoyl]-pyrrolidine 83.33
C00001233 Palmitic acid
n-Hexadecanoic acid
Hexadecanoic acid		 82.86
C00012497 Parvinolide
[3aS-(3aR*,6E,10aR*)]-3,3a,4,5,8,9,10,10a-Octahydro-2,2,6-trimethyl-10-methylene-2H-cyclonona[b]furan-2-one		 82.86
C00020417 11-Hydroxy-4-guaien-3-one 82.86
C00021705 Germacrene-D-lactone 82.86
C00028377 Huperzine W 82.86
C00035550 Butyl laurate 82.86
C00011589 (+)-Isoaminobisabolenol b
Isoaminobisabolenol b		 82.35
C00011590 (+)-Isoaminobisabolenol a
Isoaminobisabolenol a		 82.35
C00021875 Isoishwarone
endo-Isoishwarone		 82.35
C00038079 (+)-Gymnomitr-3(15)-en-4alpha-ol 82.35
C00044885 Litseagermacrane
(+)-Litseagermacrane		 82.35
C00050011 Bebryazulene 82.35
C00000226 (+)-9,10-Dihydro-7-iso-jasmonic acid 81.82
C00003109 Carotol 81.82
C00003145 Himachalol 81.82
C00012480 [1S-(1R*,2S*,5E,9S*)]- 6,10,10-Trimethylbicyclo[7.2.0]undec-5-ene-2-carboxaldehyde 81.82
C00012481 [1S-(1R*,2R*,5E,9S*)]-6,10,10-Trimethylbicyclo[7.2.0]undec-5-ene-2-carboxaldehyde 81.82
C00012740 Cyperol 81.82
C00012759 (+)-alpha-Cyperone
Eudesma-4,11-dien-3-one
(4aS-cis)-4,4a,5,6,7,8-Hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-2(3H)-naphthalenone		 81.82
C00012761 1,2-Dehydro-alpha-cyperone
(+)-Eudesma-1,4,11-trien-3-one
(4aS-cis)-5,6,7,8-Tetrahydro-1,4a-dimethyl-7-(1-methylethenyl)-2(4aH)-naphthalenone		 81.82
C00016569 (S)-12-Methyl-1-tetradecanamine
Medelamine B
NK 148198B		 81.82
C00016988 Isofukinone 81.82
C00017003 Fukinone
(+)-Eremophil-7(11)-en-8-one		 81.82
C00017004 Isopetasan
Dehydrofukinone
3-Desoxyisopetasol		 81.82
C00020129 (+)-Sclerosporal 81.82
C00020150 delta-Cadinol
(-)-Torreyol
Torreyol
Cedreanol
Sesquigoyol		 81.82
C00020154 tau-Muurolol
epi-alpha-Muurolol
T-Muurolol		 81.82
C00020397 Rotundone 81.82
C00020407 Karatavin 81.82
C00020410 Pogostol 81.82
C00021271 Chromolaevanedione 81.82
C00021296 10-Epivalerenol 81.82
C00021651 Axenol
(-)-Axenol
Gleenol		 81.82
C00021652 (+)-Axenol 81.82
C00021924 Isohimachalone 81.82
C00021929 Koidzumiol 81.82
C00021939 Nanaimoal 81.82
C00022619 (E,Z)-2,8-Decadiene-4,6-diyn-1-ol 3-methylcrotonate 81.82
C00030472 Heptadecane 81.82
C00035481 2-Hexyl-1-decanol 81.82
C00035560 Cetene 81.82
C00035615 Ethyl laurate 81.82
C00035639 Hexadecane
n-hexadecane		 81.82
C00035994 (E,Z)-2,4-Decadienyl isovalerate 81.82
C00037106 ent-T-muurolol 81.82
C00038048 (-)-alpha-Alasken-6beta-ol 81.82
C00038069 (+)-7-epi-Junenol 81.82
C00040347 Spilanthol 81.82
C00040747 (+)-T-cadinol 81.82
C00045049 Rubiginosic acid 81.82
C00045988 Halaminol A
(+)-Halaminol A		 81.82
C00046525 Xenitorin B
(-)-Xenitorin B		 81.82
C00048301 8-Heptadecene 81.82
C00048387 Eudesma-4(15),7-dien-1beta-ol
Eudesma-4(15),7-dien-1-beta-ol		 81.82
C00049520 Spicatine 81.82
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