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


and

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




INPUT WORD = C00012648 , 50% or more
[ Metabolite Name : Trichodermadiene , [4beta[2Z,4E,5(2R,3R)]]-12,13-Epoxy-trichothec-9-en-4-ol 5-(3-methyloxiranyl)-2,4-pentadienoate ]
Number of matched data : 94

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00012663 Trichodermadienediol A
[4beta(2Z,4E,6S,7S)]-12,13-Epoxy-trichothec-9-en-4-ol 6,7-dihydroxy-2,4-octadienoate		 95.08
C00012667 Trichodermadienediol B
[4beta(2Z,4E,6S,7R)]-12,13-Epoxytrichothec-9-en-4-ol 6,7-dihydroxy-2,4-octadienoate		 95.08
C00012599 [4beta(2R,3R)]-Trichotheca-9,12-dien-4-ol, 5-(3-methyloxiranyl)-2,4-pentadienoate 95.00
C00012668 [4beta(2Z,4E,6S,7R)]-12,13-Epoxytrichothec-9-ene-4,16-diol 4-(6,7-dihydroxy-2,4-octadienoate) 93.65
C00012664 [4beta(2Z,4E,6S,7S)]- 12,13-Epoxytrichothec-9-ene-4,16-diol 4-(6,7-dihydroxy-2,4-octadienoate) 92.06
C00012661 Trichoverrol A
[4b(2Z,4E,6S,7S)]-4-(6,7-dihydroxy-2,4-octadienoate) 12,13-Epoxy-trichothec-9-ene-4,15-diol		 90.48
C00012665 Trichoverrol B
[4beta(2Z,4E,6S,7R)]-12,13-Epoxytrichothec-9-ene-4,15-diol 4-(6,7-dihydroxy-2,4-octadienoate)		 90.48
C00012632 Verrol (terpene)
[4beta,15(E)]-15-(5-Hydroxy-3-methyl-2-pentenoate) 12,13-epoxytrichothec-9-ene-4,15-diol		 86.67
C00046523 Xenitacin
(+)-Xenitacin		 86.67
C00012614 8-Acetylneosolaniol
Neosoloaniol monoacetate		 85.71
C00012651 Toxin HT 2 85.71
C00012635 Nivalenol 4,15-diacetate
Nivalenol diacetate
Saubinin I
12,13-Epoxy-3a,4b,7a,15-tetrahydroxytrichothec-9-en-8-one 4,15-diacetate		 85.00
C00023184 Eupalinilide G
Eupatochinilide III		 85.00
C00003404 Asebotoxin II 83.61
C00038216 24-epi-Cyclocitrinol 83.61
C00043356 Caseamembrin F
(+)-Caseamembrin F		 83.61
C00003129 Diacetoxyscirpenol 83.33
C00012630 4,15-Diacetylverrucarol
Antibiotic A 2
Di-O-acetylverrucarol		 83.33
C00012636 (3alpha,4beta,7alpha)12,13-Epoxy-trichothec-9-ene-3,4,7,15-tetrol 4,15-diacetate 83.33
C00012639 Isoneosolaniol
NT 1
Toxin NT 1
Toxin T 1		 83.33
C00012641 (3alpha,4beta)-4,15-bis(Acetyloxy)-12,13-epoxy-3-hydroxytrichothec-9-en-8-one 83.33
C00016169 RES 1149-2 83.33
C00017297 Dendryphiellin E 83.33
C00017352 [4S-[4alpha,4aalpha,5alpha,6alpha(Z),8aalpha]]-4-(Acetyloxy)-4,4a,5,6,7,8,8a,9-octahydro-3,4a,5-trimethylnaphtho[2,3-b]furan-6-yl ester 2-methyl-2-butenoic acid 83.33
C00023492 Isolinaritriol 15,16-diacetate 83.33
C00025492 Cycloxobuxoviricine 83.33
C00039005 Diacarperoxide D
(-)-Diacarperoxide D		 83.33
C00039414 Inflexanin B 83.33
C00039425 Isariotin C
(-)-Isariotin C		 83.33
C00040063 Precyclocitrinol B 83.33
C00041267 3-Acetyl-14,15-epoxy-xeniolide H 83.33
C00046806 Macrolactin F 83.33
C00048695 Durumolide A
(-)-Durumolide A		 83.33
C00042345 Caseargrewiin D
(-)-Caseargrewiin D		 82.26
C00050322 7,8-Epoxyzahavin A
(+)-7,8-Epoxyzahavin A		 82.26
C00000565 Pravastatin 81.97
C00022582 6alpha-Angeloyloxy-4alpha-hydroxy-3,4,13,14-tetrahydrokolavenic acid 81.97
C00031574 Ailantinol A 81.97
C00034693 Stemokerrine 81.97
C00035920 Phellodonic acid 81.97
C00040059 Pordamacrine B 81.97
C00041391 Briarellin R 81.97
C00041979 Zinagrandinolide B 81.97
C00000169 1beta,10alpha-Epoxy-8beta-hydroxy-14-acetoxy-4E,11(13)-germacradien-12,6-olide 81.67
C00001657 Norerythrostachaldine 81.67
C00001670 Thalicsessine 81.67
C00011807 8-(2R,3R,Epoxy-2-methylbutanoyl)-8alpha,9beta-dihydroxy-1(10)E,4E,11(13)-germacratrien-12,6beta-olide 81.67
C00011986 [3aS-[3aalpha,4beta(Z),5beta,6alpha,7alpha,7abeta]]-7-(Acetyloxy)-6-ethenyl-5-(1-formylethenyl)octahydro-6-methyl-3-methylene-2-oxo-4-benzofuranyl ester 2-methyl-2-butenoic acid 81.67
C00012193 3-Desacetoxyursiniolide B 81.67
C00012613 Neosolaniol
Neozolaniol
Solaniol
Solaniol
(3alpha,4beta,8alpha)-12,13-Epoxy-trichothec-9-ene-3,4,8,15-tetrol 4,15-diacetate		 81.67
C00012631 (+)-Calonectrin
Calonectrin		 81.67
C00013009 Isosilerolide
[3S-[3alpha(Z),3aalpha,5aalpha,6beta,9abeta,9balpha]]-6-(Acetyloxy)-2,3,3a,4,5,5a,6,7,9a,9b-decahydro-3,5a,9-trimethyl-2-oxonaphtho[1,2-b]furan-3-yl ester 2-methyl-2-butenoic acid		 81.67
C00015667 Feigrisolide D 81.67
C00015935 Macrolactin I 81.67
C00015937 Macrolactin K 81.67
C00015938 Macrolactin L 81.67
C00015939 Macrolactin M 81.67
C00016168 RES 1149-1 81.67
C00017242 Antibiotic DT 136A
Cochleamycin A
DT 136A		 81.67
C00017342 [4aS-[4aalpha,5alpha,6beta,7alpha(Z),8abeta]]- 6-(Acetyloxy)-4,4a,5,6,7,8,8a,9-octahydro-3,4a,5-trimethylnaphtho[2,3-b]furan-7-yl ester 2-methyl-2-butenoic acid 81.67
C00017351 6beta-Acetoxyfuranoeremophilan-3alpha-yl angelate 81.67
C00018337 (+)-Dihydrocompactin
4a,5-Dihydrocompactin
Dihydrocompactin		 81.67
C00020527 8beta-Hydroxy-9beta-(5-acetoxy-tiglinoyloxy)-lasiolaenin 81.67
C00020991 Clementein 81.67
C00020992 Clementein B 81.67
C00020993 Clementein C 81.67
C00022337 15,16-Diacetoxycarterochaetol 81.67
C00022347 Varodiol diacetate 81.67
C00023490 Isolinaritriol 12,16-diacetate 81.67
C00023692 11,15-O,O-Diacetylcyathatriol 81.67
C00024924 Lepedine 81.67
C00030377 Gibberosin I 81.67
C00031436 Vibsanin B 81.67
C00034370 14-Acetylandrographolide 81.67
C00035075 Cryptoporic acid I 81.67
C00036812 Blazeispirol F
(-)-Blazeispirol F		 81.67
C00036857 Caesalmin B
(+)-Caesalmin B		 81.67
C00037716 Rabdosin A
(-)-Rabdosin A		 81.67
C00038353 Aculeatol A
(-)-Aculeatol A		 81.67
C00038354 Aculeatol B
(+)-Aculeatol B		 81.67
C00038356 Aculeatol D 81.67
C00038577 Bakkenolide H
(-)-Bakkenolide H		 81.67
C00040118 Pulchellamine G
(+)-Pulchellamine G		 81.67
C00040134 CID is old! 81.67
C00040662 Wortmannilactone A
(-)-Wortmannilactone A		 81.67
C00041357 Asbestinin 24
(+)-Asbestinin 24		 81.67
C00043705 Melissoidesin P
(-)-Melissoidesin P		 81.67
C00044377 Vilmorinine C
(+)-Vilmorinine C		 81.67
C00044378 Vilmorinine D
(-)-Vilmorinine D		 81.67
C00045603 Acalycixeniolide E
(+)-Acalycixeniolide E		 81.67
C00046630 Bipinnatolide K
(-)-Bipinnatolide K		 81.67
C00047599 TK-57-164A 81.67
C00048764 Macrolactin T
(-)-Macrolactin T		 81.67
C00049775 3beta-Acetoxy-14-n-butyryloxy-10-deoxyfloridanolide
(+)-3beta-Acetoxy-14-n-butyryloxy-10-deoxyfloridanolide		 81.67
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