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


and

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





INPUT WORD = C00003386 , 50% or more
[ Metabolite Name : Vernoflexin , Vernoflexine , Zaluzanin C senecioate ]
Number of matched data : 85

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00020521 Diaspanolide A 98.00
C00012847 Decahydro-alpha,4a-dimethyl-8-methylene-7-[(3-methyl-1-oxo-2-butenyl)oxy]-2-naphthaleneacetic acid 96.00
C00020800 Vernudifloride 96.00
C00020802 [3aS-(3aalpha,5alpha,6aalpha,9aalpha,9bbeta)]-Dodecahydro-3,6,9-tris(methylene)-2-oxoazuleno[4,5-b]furan-5-yl ester 3-methyl-2-butenoic acid 96.00
C00045463 Zaluzanin C isovalerate
(+)-Zaluzanin C isovalerate
96.00
C00012848 Decahydro-alpha,4a-dimethyl-8-methylene-7-[(2-methyl-1-oxo-2-butenyl)oxy]-2-naphthaleneacetic acid 94.00
C00012850 Decahydro-alpha,4a-dimethyl-8-methylene-7-(3-methyl-1-oxobutoxy)-2-naphthaleneacetic acid 94.00
C00020893 Carolenin 92.31
C00020959 3-O-TigloylCarolenalin 92.31
C00012830 [2R-[2alpha,4aalpha,5beta(Z),8abeta]]-Decahydro-4a-methyl-alpha,8-bis(methylene)-5-[(2-methyl-1-oxo-2-butenyl)oxy]-2-naphthaleneacetic acid 92.00
C00020801 [3aS-[3aalpha,5alpha(Z),6aalpha,9aalpha,9bbeta]]-Dodecahydro-3,6,9-tris(methylene)-2-oxoazuleno[4,5-b]furan-5-yl ester 2-methyl-2-butenoic acid 92.00
C00020824 8alpha-Isovaleryloxyeremanthine 92.00
C00044990 Pachyclavulariolide N
(-)-Pachyclavulariolide N
92.00
C00044991 Pachyclavulariolide O
(-)-Pachyclavulariolide O
92.00
C00045462 Zaluzanin C isobutyrate
(+)-Zaluzanin C isobutyrate
92.00
C00020479 Angeloylcumambrin B 90.38
C00020506 8alpha-Acetoxyzaluzanin D 90.38
C00038458 Annuolide F 90.38
C00011780 Mollisorin A 90.20
C00011976 11,13-Dehydromelitensin diacetate 90.20
C00020890 Arctodecurrolide 90.00
C00021348 8-Senecioyloxy-14-thapsanol 90.00
C00021406 Lapidin 90.00
C00041322 Agathic acid 90.00
C00045156 15-Isovaleroyloxycostunolide 90.00
C00047064 Lobohedleolide
(+)-Lobohedleolide
90.00
C00035790 3,15-Di-O-acetyl-9beta-hydroxyamphoricarpolide 88.89
C00020624 [3aS-[3aalpha,7alpha(E),7abeta,8abeta,8balpha,8cbeta]]-2,3,3a,4,5,7,7a,8a,8b,8c-Decahydro-6,8a-dimethyl-3-methylene-2-oxooxireno[2,3]azuleno[4,5-b]furan-7-yl ester 2-methyl-2-butenoic acid 88.68
C00020898 Hymenoratin F 88.68
C00020899 2-O-Tigloylhymenoratin E 88.68
C00020900 Hymenoratin E 88.68
C00003243 Cynaropicrin 88.46
C00003366 Saupirin
sauparine
88.46
C00012874 Pulchellin F
[3aR-[3aalpha,4aalpha,6beta,7alpha(Z),8abeta,9aalpha]]-Dodecahydro-6-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-7-yl ester 2-methyl-2-butenoic acid
88.46
C00012979 Chapinolin
[3aR-[3aalpha,4alpha(Z),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid
88.46
C00012983 Arturin
[3aR-[3aalpha,4beta(Z),5abeta,6beta,9aalpha,9bbeta]]-Dodecahydro-6-hydroxy-5a-methyl-3,9-bis(methylene)-2-oxonaphtho[1,2-b]furan-4-yl ester 2-methyl-2-butenoic acid
88.46
C00013011 Lasolid
Lasolide
[3S-[3alpha(Z),3aalpha,5aalpha,6alpha,9abeta,9balpha]]-Dodecahydro-6-hydroxy-3,5a-dimethyl-9-methylene-2-oxonaphtho[1,2-b]furan-3-yl ester 2-methyl-2-butenoic acid
88.46
C00020525 9beta-Hydroxy-8beta-tiglinoyloxy-lasiolaenin 88.46
C00020794 [3aR-[3aalpha,4beta(E),6aalpha,9aalpha,9bbeta]]-2,3,3a,4,5,6,6a,7,9a,9b-Decahydro-9-methyl-3,6-bis(methylene)-2-oxoazuleno[4,5-b]furan-4-yl ester 4-hydroxy-2-methyl-2-butenoic acid 88.46
C00020943 [3R-(3alpha,3aalpha,4alpha,4abeta,7abeta,8alpha,9aalpha)]-2,3,3a,4,4a,7,7a,8,9,9a-Decahydro-3,5,8-trimethyl-2,7-dioxoazuleno[6,5-b]furan-4-yl ester 3-methyl-2-butenoic acid 88.46
C00021076 Cumanin diacetate 88.46
C00021690 Hysterin acetate 88.46
C00003339 Nobilin 88.24
C00011756 Millefin 88.24
C00011977 Isoarbutifolin 88.24
C00020743 [1R-(1alpha,4beta,4abeta,6alpha,8aalpha)]-6-(Acetyloxy)-4-ethoxy-1,2,3,4,4a,5,6,8a-octahydro-4,7-dimethyl-a-methylene-1-naphthaleneacetic acid methyl ester 88.24
C00022666 3beta-Angeloyloxyisocostic acid methyl ester 88.24
C00038695 Capillolide
(+)-Capillolide
88.24
C00048668 Crassumolide C 88.24
C00012174 Hallerin 88.00
C00012696 3-O-Angeloylcuauhtemone
Cuauhtemone-3-angelicate
[1S-[1alpha,2alpha(Z),4abeta,8aalpha]]-Decahydro-1-hydroxy-1,4a-dimethyl-7-(1-methylethylidene)-6-oxo-2-naphthalenyl ester 2-methyl-2-butenoic acid
88.00
C00012849 Decahydro-alpha,4a-dimethyl-8-methylene-7-(2-methyl-1-oxopropoxy)-2-naphthaleneacetic acid 88.00
C00012868 Subcordatolide C
[3aR-(3aalpha,4alpha,4aalpha,8beta,8abeta,9aalpha)]-Dodecahydro-8-hydroxy-8a-methyl-3,5-bis(methylene)-2-oxonaphtho[2,3-b]furan-4-yl ester 2-methyl-propanoic acid
88.00
C00012910 Subcordatolide E
[3aR-(3aalpha,4aalpha,8beta,8abeta,9abeta)]-2,3,3a,4,4a,7,8,8a,9,9a-Decahydro-5,8a-dimethyl-3-methylene-2-oxonaphtho[2,3-b]furan-8-yl ester 2-methylpropanoic acid
88.00
C00013052 8alpha-Isovaleryloxygazaniolide
[3aR-(3aalpha,4alpha,5abeta,9aalpha,9bbeta)]-2,3,3a,4,5,5a,9a,9b-Octahydro-5a,9-dimethyl-3-methylene-2-oxonaphtho[1,2-b]furan-4-yl ester 3-methylbutanoic acid
88.00
C00017359 [4S-(4alpha,4aalpha,5alpha,8aalpha)]-4,4a,5,6,7,8,8a,9-Octahydro-8a-hydroxy-3,4a,5-trimethylnaphtho[2,3-b]furan-4-yl ester 3-methyl-2-butenoic acid 88.00
C00017418 [4S-(4alpha,4aalpha,5alpha,8abeta)]-4,4a,5,6,7,8,8a,9-Octahydro-3,4a,5-trimethyl-9-oxonaphtho[2,3-b]furan-4-yl ester 3-methyl-2-butenoic acid 88.00
C00020729 Prutenin 88.00
C00020798 Subexpinnatin 88.00
C00020854 Solstitialin A 13-acetate 88.00
C00020860 9beta-Hydroxykandavanolide 88.00
C00021347 8-Angeloyloxy-14-thapsanol 88.00
C00021686 Salonitenolide 8-O-angelate 88.00
C00021702 9beta-Isovaleryloxy costunolide 88.00
C00022225 (E)-ent-3beta-3,18-Dihydroxy-8(17),13-labdadien-15-oic acid 88.00
C00022226 Henrilabdane A
(-)-Henrilabdane A
88.00
C00022434 8alphaH,ent-3beta-Hydroxy-17-oxo-13Z-labden-15oic acid 88.00
C00022435 8alphaH,ent-3eta,17-Dioxo-13Z-labden-15-oic acid 88.00
C00022436 8betaH,ent-3beta-Hydroxy-17-oxo-13Z-labden-15oic acid 88.00
C00022769 ent-8(17),13-Labdadien-15,16-olid-18-oic acid 88.00
C00023292 ent-8alphaH,13E-Labdene-15,17-dioic acid 88.00
C00023293 ent-8alphaH,13Z-Labdene-15,17-dioic acid 88.00
C00023443 Koanophyllic acid C 88.00
C00023499 Ephemeric acid 88.00
C00031557 Acanthokoreoic acid A 88.00
C00032545 Zaluzanin D 88.00
C00033595 8alpha-Isobutyryloxydouglanin 88.00
C00037497 Methyl labd-13-en-15-oate 88.00
C00038290 5-Dehydrosinularolide 88.00
C00040199 Salograviolide B 88.00
C00041459 Crassocolide E
(+)-Crassocolide E
88.00
C00043377 Cervicol 88.00
C00046984 (7Z)-Lobohedleolide
(+)-(7Z)-Lobohedleolide
88.00
C00048756 Lobophytolide D
(-)-Lobophytolide D
88.00
C00049965 8beta-Isobutyryloxycumambranolide
(-)-8beta-Isobutyryloxycumambranolide
88.00
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