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


and

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




INPUT WORD = C00016979 , 50% or more
[ Metabolite Name : Isovalencenic acid ]
Number of matched data : 66

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00017486 Lemnalactone 94.44
C00016985 (+)-Isovalencenol
Isovalencenol		 94.29
C00017326 Dugesialactone
[3aS-(3aalpha,4aalpha,5alpha,9aalpha)]-3a,4,4a,5,6,7,9,9a-Octahydro-4a,5-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one		 91.67
C00017327 Xanthanodiene
[3aR-(3aalpha,4abeta,5beta,9aalpha)]-3a,4,4a,5,6,7,9,9a-octahydro-4a,5-dimethyl-3-methylene-naphtho[2,3-b]furan-2(3H)-one		 91.67
C00017331 Xanthanene
[3R-(3alpha,3aalpha,4abeta,5beta,9aalpha)]-3a,4,4a,5,6,7,9,9a-Octahydro-3,4a,5-trimethyl-naphtho[2,3-b]furan-2(3H)-one		 91.67
C00017487 7-Epilemnalactone 91.67
C00029560 5-Epidilatanolide A 91.67
C00029561 5-Epidilatanolide B 91.67
C00017469 1(10)-Aristolen-12-al
[1S-(1alpha,1aalpha,7alpha,7aalpha,7balpha)]-1a,2,3,5,6,7,7a,7b-octahydro-1,7,7a-trimethyl-1H-cyclopropa[a]naphthalene-1-carboxaldehyde		 91.43
C00039823 Nardosinanol B
(-)-Nardosinanol B		 91.43
C00017485 2-Deoxy-12-oxolemnacarnol 89.47
C00044860 Lemnal-1(10)-ene-2,12-dione
(-)-Lemnal-1(10)-ene-2,12-dione		 89.47
C00017292 Tessaric acid
[2R-(2alpha,8alpha,8aalpha)]-1,2,3,4,6,7,8,8a-Octahydro-8,8a-dimethyl-a-methylene-6-oxo-2-naphthaleneacetic acid		 89.19
C00017293 11S,13-Dihydrotessaric acid
[2R-[2alpha(S*),8alpha,8aalpha]]-1,2,3,4,6,7,8,8a-Octahydro-alpha,8,8a-trimethyl-6-oxo-2-naphthaleneacetic acid		 89.19
C00034475 Dehydroflourensic acid
(-)-Dehydroflourensic acid		 89.19
C00003258 Eremofrullanolide 88.89
C00003259 Eremophilenolide
Eremophylenolide		 88.89
C00012877 Callitrisin
[3R-(3alpha,3aalpha,4abeta,8aalpha,9aalpha)]-3a,4,4a,5,6,8a,9,9a-Octahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one		 88.89
C00017336 Tetrahydroligularenolide 88.89
C00017337 Dihydroeremofrullanolide 88.89
C00021715 (4S,5S,7R,8R)-10(14),11(13)-Ratibidadien-12,8-olide 88.89
C00016974 (1S-cis)-1,2,3,5,6,7,8,8a-Octahydro-1,8a-dimethyl-7-(1-methylethylidene)naphthalene 88.57
C00016981 [2R-(2alpha,8alpha,8aalpha)]-1,2,3,5,6,7,8,8a-Octahydro-8,8a-dimethyl-a-methylene-2-naphthaleneacetic acid 88.57
C00016998 (+)-Valencenol
Valencenol		 88.57
C00017291 9-Oxo-1(10),11(13)-eremophiladien-12-al 88.57
C00020134 gamma-Muurolen-15-oic acid 88.57
C00021705 Germacrene-D-lactone 88.57
C00029375 11,12-Dihydroxy-6,10-eremophiladiene 88.57
C00046261 Oxyphyllol B
(+)-Oxyphyllol B		 88.57
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		 86.84
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		 86.84
C00017396 Palmosalide A 86.84
C00017439 2-Oxo-eremophila-1(10),11(13)-dien-12,8beta-olide 86.84
C00044533 Armatin A
(-)-Armatin A		 86.84
C00044534 Armatin B
(-)-Armatin B		 86.84
C00017294 Flourensic acid
9-Oxo-7xi-eremophil-11(13)-en-12-oic acid		 86.49
C00021064 Damsinic acid 86.49
C00043349 Canusesnol J
(-)-Canusesnol J		 86.49
C00003242 (+)-beta-Cyclocostunolide
beta-Cyclocostunolide[3aS-(3aalpha,5abeta,9aalpha,9bbeta)]-Decahydro-5a-methyl-3,9-bis(methylene)-naphtho[1,2-b]furan-2(3H)-one		 86.11
C00003245 Dehydrocostus lactone 86.11
C00003306 Isoalantolactone
Isoallantolactone
Isohelenin		 86.11
C00011946 6-Hydroxy-14-sesquilimonenoic acid 86.11
C00012878 [3R-(3alpha,3aalpha,4abeta,8aalpha,9aalpha)]-Decahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(3H)-one
Dihydroallitrisin		 86.11
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		 86.11
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		 86.11
C00012893 (+)-Alantolactone
Alant camphor
Elecampane camphor
Eupatal
Inula camphor
Alantolactone		 86.11
C00012897 Lindestrenolide
[4aS-(4aalpha,8abeta,9abeta)]-4a,5,6,8a,9,9a-Hexahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2(4H)-one		 86.11
C00013030 Feropodin
[3S-(3alpha,3aalpha,5abeta,9aalpha,9bbeta)]-3a,4,5,5a,9a,9b-hexahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 86.11
C00013032 [3aR-(3aalpha,5abeta,9abeta,9bbeta)]-Decahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one
ent-cis-beta-Cyclocostunolide		 86.11
C00013035 Morifolin B
[3aS-(3aalpha,5aalpha,9aalpha,9bbeta)]-Decahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one		 86.11
C00017334 (-)-Ligularenolide
Ligularenolid
Ligularenolide		 86.11
C00017394 10alpha-Furanoligularenone 86.11
C00017395 9-Oxoeuryopsin
Furanoeremophil-1(10)-en-9-one		 86.11
C00017468 Debilon
Debilone		 86.11
C00017484 2-Deoxylemnacarnol 86.11
C00020907 Columellarin 86.11
C00020908 Dihydrocolumellarin 86.11
C00020914 Elehirtanolide 86.11
C00021013 5,10-bis-epi-Isoalantolactone 86.11
C00021419 Hercynolactone
Fastigiolide		 86.11
C00021852 alpha-Santalene-12-oic acid
alpha-santalenoic acid		 86.11
C00021881 Hinokiic acid
Thujopsenic acid
Widdrenic acid		 86.11
C00021892 3(12)-Gymnomitren-15-oic acid 86.11
C00037050 Dihydro-beta-Cyclocostunolide 86.11
C00045508 11alpha,13-Dihydroalantolactone
(-)-11alpha,13-Dihydroalantolactone		 86.11
C00046476 Tubipolide B
(-)-Tubipolide B		 86.11
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