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


and

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




INPUT WORD = C00038863 , 50% or more
[ Metabolite Name : Crassumolide E , (-)-Crassumolide E ]
Number of matched data : 81

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00042722 Mayolide A 95.83
C00038862 Crassumolide D
(-)-Crassumolide D		 93.75
C00042360 Cembranolide B 92.00
C00011419 [R-[R*,R*-(Z,E,E,E)]]-1-(3,3-Dimethyloxiranyl)-9-hydroxy-3,7-dimethyl-3,5,7-nonatrienyl ester 2-methyl-2-butenoic acid 91.67
C00022113 1,6,10-Phytatriene-3,5,14,15-tetral 91.67
C00023356 11,16-Dihydroxy-10beta,20-epoxy-9,10-seco-ent-labda-8E,13Z-diene 91.67
C00041459 Crassocolide E
(+)-Crassocolide E		 91.67
C00022071 Ligantrol 90.00
C00038290 5-Dehydrosinularolide 90.00
C00021702 9beta-Isovaleryloxy costunolide 89.80
C00023364 Villenatriolone 89.80
C00039760 Methyl-2-epinuapapuinoate 89.80
C00039883 Nuapapuin A methyl ester
(+)-Nuapapuin A methyl ester		 89.80
C00042704 Lobophytol 89.80
C00047064 Lobohedleolide
(+)-Lobohedleolide		 89.80
C00050213 Sandensolide 89.80
C00022221 3alpha-Hydroxyisoagatholal 89.58
C00022222 3beta-Hydroxyisoagatholal 89.58
C00022285 19-Hydroxy-2-oxomanoyl oxide 89.58
C00022481 15-Hydroxy-8,E-13-labdadien-19-oic acid 89.58
C00022524 Viscidic acid A
ent-15-Hydroxy-8(17),13E-labdadien-18-oic acid		 89.58
C00022708 (+)-Isocupressic acid
Isocupressic acid
15-Hydroxy-8(17),13E-labdadien-15-oic acid		 89.58
C00023355 11,15-Dihydroxy-10beta,20-epoxy-9,10-seco-ent-labda-8E,13E-diene 89.58
C00030188 ent-Verticillanediol
(1S,12R)-ent-Verticilla-3E,7E-diene-1,12-diol		 89.58
C00035303 ent-5-epi-Verticillanediol
ent-12-epi-Verticillanediol		 89.58
C00042883 Pulicanadiene C
(-)-Pulicanadiene C		 89.58
C00048668 Crassumolide C 88.24
C00050060 Dihydroflexibilolide
(-)-Dihydroflexibilolide		 88.24
C00050099 Flexibilolide
(-)-Flexibilolide		 88.24
C00040316 Sinulariolide 88.00
C00044990 Pachyclavulariolide N
(-)-Pachyclavulariolide N		 88.00
C00044991 Pachyclavulariolide O
(-)-Pachyclavulariolide O		 88.00
C00012174 Hallerin 87.76
C00021686 Salonitenolide 8-O-angelate 87.76
C00021701 9beta-(2-Methyl butyryloxy)-costunolide 87.76
C00022059 (E,Z,E,Z)-2-(9-Hydroxy-4,8-dimethyl-3,7-nonadienyl)-6-methyl-2,6-octadienedioic acid 87.76
C00022060 (E,Z,Z,Z)-2-(9-Hydroxy-4,8-dimethyl-3,7-nonadienyl)-6-methyl-2,6-octadienedioic acid 87.76
C00022225 (E)-ent-3beta-3,18-Dihydroxy-8(17),13-labdadien-15-oic acid 87.76
C00022226 Henrilabdane A
(-)-Henrilabdane A		 87.76
C00022576 16,17,18,20-Tetrahydroxy-10,11,14,15-tetrahydronerylgeraniol 87.76
C00023329 7alpha-Methoxy-8-labdene-3beta,15-diol 87.76
C00023331 3beta-Methoxy-8-labdene-7beta,15-diol 87.76
C00029324 (3R,4R,7R,8R,12R)-ent-3,4:7,8-Diepoxyverticillan-12-ol
Verticillol bis epoxide
Verticillol diepoxide		 87.76
C00041655 Manaarenolide G
(-)-Manaarenolide G		 87.76
C00041656 Manaarenolide H
(-)-Manaarenolide H		 87.76
C00046984 (7Z)-Lobohedleolide
(+)-(7Z)-Lobohedleolide		 87.76
C00022046 11,15-Epoxy-3(20)-phytene-1,2-diol 87.50
C00022049 Geranyllinalol-19,9-olide 87.50
C00022131 (E,E,E,E)-1,5,15-Trihydroxy-2,6,10,13-phytatetraen-12-one 87.50
C00022197 Jhanic acid 87.50
C00022239 (ent-13R)-13,18-Dihydroxy-8,14-labdadien-7-one 87.50
C00022241 (8alpha,13E)-8,15-Dihydroxy-13-labden-19-al 87.50
C00022282 8,13-Epoxy-3beta-hydroxylabd-14-en-2-one 87.50
C00022299 2,3-Dihydroxymanoyl oxide 87.50
C00022407 13S-Hydroxy-7,14-labdadien-19-oic acid 87.50
C00022476 8,13E-Labdadien-15,19-diol 87.50
C00022479 15-Hydroxy-8,13E-labdadien-19-al 87.50
C00022484 13alpha-Hydroxy-8,14-labdadien-19-oic acid 87.50
C00022520 Kayadiol
4-Epiagathadiol
8(17),13E-Labdadien-15,18-diol		 87.50
C00022610 7alpha,15-Dihydroxy-ent-labda-8,13E-diene 87.50
C00022611 7beta,15-Dihydroxy-ent-labda-8,13E-diene 87.50
C00022613 15-Hydroxy-8,9-dioxo-seco-ent-labd-13E-ene 87.50
C00022614 Gypopinifolone 87.50
C00022707 Isoagatholal 87.50
C00022710 19-Hydroxy-8(17),13Z-labdadien-15-al 87.50
C00022722 13-Epicupressic acid
(+)-13-Epicupressic acid		 87.50
C00022745 Villenatriol
8(17),13E-Labdadiene-7alpha,15,19-triol		 87.50
C00023210 [1S-[1alpha(S*),4abeta,7beta,8aalpha]]-alpha-Ethenyl-1,4,4a,5,6,7,8,8a-octahydro-7-hydroxy-a,2,5,5,8a-pentamethyl-1-naphthalenepropanol 87.50
C00023211 [2S-[2alpha,3alpha,4abeta,5beta(S*),8aalpha]]-1,2,3,4,4a,5,8,8a-Octahydro-5-(3-hydroxy-3-methyl-4-pentenyl)-1,1,4a,6-tetramethyl-2,3-naphthalenediol 87.50
C00023354 11,15-Dihydroxy-9,10-seco-ent-labda-8E,13E,(20),triene-3-one 87.50
C00023375 9,10-Seco-8,10(20),13-labdatriene-3,11,15-triol 87.50
C00023376 11,15-Dihydroxy-8,10(20),13-labdatriene-3-one 87.50
C00030378 Gibberosin J
(+)-Gibberosin J		 87.50
C00033503 ent-Verticillol 87.50
C00035304 ent-5-epi-Verticillol
(+)-ent-5-epi-Verticillol		 87.50
C00038861 Crassumolide B
(+)-Crassumolide B		 87.50
C00045606 Acalycixeniolide I
(+)-Acalycixeniolide I		 87.50
C00045607 Acalycixeniolide J
(+)-Acalycixeniolide J		 87.50
C00045780 Cladiellisin
(-)-Cladiellisin		 87.50
C00046897 Sarcocrassolide
(+)-Sarcocrassolide		 87.50
C00049067 12,14-Dihydroxyphytol
(-)-12,14-Dihydroxyphytol		 87.50
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