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


and

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




INPUT WORD = C00003363 , 50% or more
[ Metabolite Name : Santamarin , Santamarine , Balchanin ]
Number of matched data : 72

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00013037 11beta,13-Dihydrosantamarin
11,13-Dihydrosantamarine
Dihydrosantamarin		 100.00
C00013223 Douglanin
Douglanine
[3aS-(3aalpha,5abeta,6alpha,9aalpha,9bbeta)]-3a,4,5,5a,6,7,9a,9b-Octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 100.00
C00034364 11alpha,13-Dihydrosantamarin 100.00
C00013058 Herbolide G
[3S-(3alpha,3aalpha,5beta,5abeta,9aalpha,9bbeta)]-3a,4,5,5a,6,7,9a,9b-Octahydro-5-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 97.37
C00012974 [3aR-(3aalpha,4alpha,5abeta,6beta,9aalpha,9bbeta)]-3a,4,5,5a,6,7,9a,9b-Octahydro-4,6-dihydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
8alpha-Hydroxybalchanin		 95.00
C00012988 [3aS-(3aalpha,5alpha,5abeta,6alpha,9aalpha,9bbeta)]-3a,4,5,5a,6,7,9a,9b-Octahydro-5,6-dihydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one
1alpha,9alpha-Dihydroxy-alpha-cyclocostunolide		 95.00
C00013005 Gallicadiol
[3S-(3alpha,3aalpha,5abeta,6beta,9abeta,9bbeta)]-3a,4,5,5a,6,7,9a,9b-Octahydro-6,9a-dihydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 95.00
C00033594 8alpha-Hydroxydouglanin
Deacetylludalbin		 95.00
C00020605 Arglabin 94.87
C00003205 Achillin 94.74
C00003248 Desacetoxymatricarin
Leucodin		 94.74
C00012831 [2R-(2alpha,4aalpha,8abeta)]-Decahydro-4a-methyl-a,8-bis(methylene)-5-oxo-2-naphthaleneacetic acid
1-Oxo-4(15),11(13)-eudesmadien-12-oic acid		 94.74
C00012923 [3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-3a,4,4a,7,8,8a,9,9a-Octahydro-5-(hydroxymethyl)-8a-methyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one
15-Hydroxyisoalloalantolactone		 94.74
C00013038 Magnolialide
Splendolide
[3aS-(3aalpha,5abeta,6beta,9bbeta)]-3a,4,5,5a,6,7,8,9b-Octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 94.74
C00013039 [3aS-(3aalpha,5aalpha,6alpha,9balpha)]- 3a,4,5,5a,6,7,8,9b-Octahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one 94.74
C00013040 (+)-Reynosin
Reinosin
Reynosin		 94.74
C00013041 11betaH,13-Dihydroreynosin
Dihydroreynosin
[3S-(3alpha,3aalpha,5abeta,6beta,9aalpha,9bbeta)]-Decahydro-6-hydroxy-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2(3H)-one		 94.74
C00013044 Arbusculin C
[3aS-(3aalpha,5abeta,9aalpha,9bbeta)]-Decahydro-9a-hydroxy-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2(3H)-one		 94.74
C00013054 Artesin
Artesin(terpene)
Artemalin
[3S-(3alpha,3aalpha,5abeta,6beta,9bbeta)]-3a,4,5,5a,6,7,8,9b-Octahydro-6-hydroxy-3,5a,9-trimethylnaphtho[1,2-b]furan-2(3H)-one		 94.74
C00020719 1alpha-Hydroxy-5alpha,11betaH-guaia-3,10(14)-dien-6alpha,12-olide 94.74
C00021698 8-epi-Isovangustin 94.74
C00034363 11alpha,13-Dihydroreynosin
11-epi-Dihydroreynosin		 94.74
C00013059 Ludovicin C
[3aS-(3aalpha,5abeta,6alpha,9bbeta)]-3a,5,5a,6,7,9b-Hexahydro-6-hydroxy-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2,8(3H,4H)-dione		 92.50
C00012334 Argentiolide A 92.31
C00016960 Ratibinolide
Ratibinolide I		 92.31
C00020611 Arborescin 92.31
C00020612 Sieversinin 92.31
C00003218 Aromaticin 92.11
C00003241 alpha-Cyclocostunolide 92.11
C00003300 7alpha-Hydroxydehydrocostus lactone 92.11
C00003328 Micheliolide 92.11
C00003355 Pseudoivalin 92.11
C00003364 Santonin
Semenen
(-)-alpha-Santonin
(-)-Santonin
a-Santonin
[3S-(3alpha,3aalpha,5abeta,9bbeta)]-3a,5,5a,9b-Tetrahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 92.11
C00003365 beta-Santonin
[3R-(3alpha,3abeta,5aalpha,9balpha)]-3a,5,5a,9b-Tetrahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 92.11
C00012035 Shonachalin D 92.11
C00012209 gamma-Lacton 3,6alpha-dihydroxy-4betaH-Germacr-1(10)-en-12-oic acid
Hydroxypelenolide		 92.11
C00012210 Ketopelenolide A
Oxopelenolide a		 92.11
C00012344 Quadrangolide 92.11
C00012388 Liabinolide 92.11
C00012393 Frutescin 92.11
C00012724 alpha-Costic acid
Eudesma-3,11(13)-dien-12-oic acid
[2R-(2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-alpha-methylene-2-naphthaleneacetic acid		 92.11
C00012829 [2R-(2alpha,4aalpha,5beta,8abeta)]-Decahydro-5-hydroxy-4a-methyl-a,8-bis(methylene)-2-naphthaleneacetic acid 92.11
C00012832 Decahydro-5-hydroxy-alpha,4a-dimethyl-8-methylene-2-naphthaleneacetic acid
1lapha-Hydroxy-4(15)-eudesmen-12-oic acid		 92.11
C00012834 [2R-(2alpha,4aalpha,8abeta)]-1,2,3,4,4a,5,6,8a-Octahydro-4a,8-dimethyl-alpha-methylene-6-oxo-2-naphthaleneacetic acid 92.11
C00012879 (+)-Isoalloalantolactone
Isoalloalantolactone
[3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-3a,4,4a,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 92.11
C00012880 Diplophyllolide A
[3aS-(3aalpha,4aalpha,8abeta,9aalpha)]-3a,4,4a,7,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one		 92.11
C00012912 Pinnatifidin (Helenium)
[3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-3,3a,4,4a,8,8a,9,9a-Octahydro-5,8a-dimethyl-3-methylenepinnatifidin
Naphtho[2,3-b]furan-2,7-dione		 92.11
C00012920 [3aS-(3aalpha,4aalpha,8abeta,9aalpha)]- 3a,4,4a,7,8,8a,9,9a-Octahydro-4a-hydroxy-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2(3H)-one
ent-7alpha-Hydroxydipophyllolide		 92.11
C00012927 Inunal
[3aR-(3aalpha,4aalpha,8abeta,9aalpha)]-2,3,3a,4,4a,7,8,8a,9,9a-Decahydro-8a-methyl-3-methylene-2-oxonaphtho[2,3-b]furan-5-carboxaldehyde		 92.11
C00012941 [3aS-(3aalpha,8abeta,9aalpha)]-3a,7,8,8a,9,9a-Hexahydro-5,8a-dimethyl-3-methylenenaphtho[2,3-b]furan-2,6(3H,4H)-dione
3-Oxodiplophyllin		 92.11
C00012944 Virginin
[3S-(3alpha,3abeta,4abeta,8aalpha,9abeta)]-3a,4a,5,8a,9,9a-Hexahydro-3,8a-dimethyl-5-methylenenaphtho[2,3-b]furan-2,6(3H,4H)-dione		 92.11
C00013036 Gazaniolide
[3aS-(3aalpha,5abeta,9aalpha,9bbeta)]-3a,4,5,5a,9a,9b-Hexahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2(3H)-one		 92.11
C00013045 (+)-Oxyfrullanolide
Oxyfrullanolide		 92.11
C00013049 [3aS-(3aalpha,5abeta,9balpha)]-3a,5a,6,7,8,9b-Hexahydro-5a,9-dimethyl-3-methylenenaphtho[1,2-b]furan-2,5(3H,4H)-dione
9-Oxotournefortiolide		 92.11
C00013051 Dehydrobrachylaenolide
[3aS-(3aalpha,5abeta,9aalpha,9bbeta)]-3a,5,5a,9,9a,9b-Hexahydro-5a-methyl-3,9-bis(methylene)naphtho[1,2-b]furan-2,8(3H,4H)-dione		 92.11
C00013077 Alloisosantonin
[3S-(3alpha,3aalpha,5abeta,9aalpha,9bbeta)]-3a,5,5a,9,9a,9b-hexahydro-3,5a-dimethyl-9-methylenenaphtho[1,2-b]furan-2,8(3H,4H)-dione		 92.11
C00013080 alpha-Tetrahydro-alpha-santonin
alpha-Tetrahydrosantonin
Artepaulin
[3S-(3alpha,3aalpha,5abeta,9alpha,9aalpha,9bbeta)]-Octahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,8(3H,4H)-dione		 92.11
C00013081 Barrelierin
Gracilin
Taurin
[3S-(3alpha,3aalpha,5abeta,9bbeta)]-3a,5,5a,7,8,9b-Hexahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,6(3H,4H)-dione		 92.11
C00013082 Finitin
[3S-(3alpha,3aalpha,5abeta,9balpha)]-3a,5,5a,7,8,9b-Hexahydro-3,5a,9-trimethylnaphtho[1,2-b]furan-2,6(3H,4H)-dione		 92.11
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		 92.11
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		 92.11
C00020718 1alpha-Hydroxy-11beta,13-dihydrokauniolide 92.11
C00020724 Cumambranolide
8-Desoxycumambrin B
Maximilianin		 92.11
C00020923 [3aR-(3aalpha,4aalpha,5alpha,9abeta)]-3a,4,4a,5,6,7,9,9a-Octahydro-5-hydroxy-5,8-dimethyl-3-methylene-azuleno[6,5-b]furan-2(3H)-one 92.11
C00020996 [3aR-(3aalpha,4aalpha,6beta,7aalpha,9abeta)]-Decahydro-6-hydroxy-3,5,8-tris(methylene)-azuleno[6,5-b]furan-2(3H)-one 92.11
C00020998 [3aR-(3aalpha,4aalpha,7aalpha,9abeta)]-Octahydro-3,5,8-tris(methylene)-azuleno[6,5-b]furan-2,6(3H,4H)-dione 92.11
C00021102 2alpha-Hydroxy-eudesm-3,11(13)-dien-12,8beta-olide 92.11
C00021696 Asperilin 92.11
C00021697 8-epi-Ivangustin 92.11
C00021704 4beta,5alpha-Epoxy-4,5-cis-inunolide 92.11
C00033643 Annuolide D 92.11
C00034365 11-epi-Artesin 92.11
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