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FRZ
FRZ
Name:5-(2-PHENYLPYRAZOLO[1,5-A]PYRIDIN-3-YL)-1H-PYRAZOLO[3,4-C]PYRIDAZIN-3-AMINE
Formula:C18 H13 N7
SMILES:n1nc5c(cc1c3c4ccccn4nc3c2ccccc2)c(nn5)N
InChi:InChI=1S/C18H13N7/c19-17-12-10-13(20-22-18(12)23-21-17)15-14-8-4-5-9-25(14)24-16(15)11-6-2-1-3-7-11/h1-10H,(H3,19,21,22,23)
Synonyms:FR180204
Definition date:2004-07-02
Last modified:2020-06-17
Identifier:5-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)-1H-pyrazolo[3,4-c]pyridazin-3-amine
FS5
FS5
Name:IRON/SULFUR PENTA-SULFIDE CONNECTED CLUSTERS
Formula:Fe8 S13
SMILES:S(SS[Fe]12|S3[Fe]|4S5|[Fe]3S1|[Fe]5S2|4)SS[Fe]67|S8[Fe]|9S|%10[Fe](S6|9)|S7[Fe]8|%10
InChi:InChI=1S/8Fe.H2S5.8S/c
Synonyms:PENTASULFIDE-LINKED IRON CUBANES
Definition date:2013-03-21
Last modified:2020-06-17
Release date:2013-04-10
FSV
FSV
Name:5-[(E)-2-(3-fluoro-4-hydroxyphenyl)ethenyl]benzene-1,3-diol
Formula:C14 H11 F O3
SMILES:Fc2cc(C=Cc1cc(O)cc(O)c1)ccc2O
InChi:InChI=1S/C14H11FO3/c15-13-7-9(3-4-14(13)18)1-2-10-5-11(16)8-12(17)6-10/h1-8,16-18H/b2-1+
Synonyms:fluoro-resveratrol
Definition date:2014-02-28
Last modified:2020-06-17
Release date:2014-05-07
Identifier:5-[(E)-2-(3-fluoro-4-hydroxyphenyl)ethenyl]benzene-1,3-diol
FT4
FT4
Name:[(3R)-3-{[(4-fluorophenyl)sulfonyl](methyl)amino}-1,2,3,4-tetrahydro-9H-carbazol-9-yl]acetic acid
Formula:C21 H21 F N2 O4 S
SMILES:CN(C2CCc1n(c3c(c1C2)cccc3)CC(O)=O)S(c4ccc(F)cc4)(=O)=O
InChi:InChI=1S/C21H21FN2O4S/c1-23(29(27,28)16-9-6-14(22)7-10-16)15-8-11-20-18(12-15)17-4-2-3-5-19(17)24(20)13-21(25)26/h2-7,9-10,15H,8,11-13H2,1H3,(H,25,26)/t15-/m1/s1
Synonyms:CAY10471
Definition date:2018-04-16
Last modified:2020-06-17
Release date:2018-10-03
Identifier:[(3R)-3-{[(4-fluorophenyl)sulfonyl](methyl)amino}-1,2,3,4-tetrahydro-9H-carbazol-9-yl]acetic acid
FTB
FTB
Name:N-{4-[1-(2-FLUOROBENZYL)-3-BUTYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YLMETHYL]-PHENYL}-ACETAMIDE
Formula:C25 H26 F N5 O3
SMILES:Fc1ccccc1CN3C(=O)N(c2nc(nc2C3=O)Cc4ccc(NC(=O)C)cc4)CCCC
InChi:InChI=1S/C25H26FN5O3/c1-3-4-13-30-23-22(24(33)31(25(30)34)15-18-7-5-6-8-20(18)26)28-21(29-23)14-17-9-11-19(12-10-17)27-16(2)32/h5-12H,3-4,13-15H2,1-2H3,(H,27,32)(H,28,29)
Synonyms:1-(2-FLUOROBENZYL)-3-BUTYL-8-(N-ACETYL-4-AMINOBENZYL)-XANTHINE
Definition date:2003-01-08
Last modified:2020-06-17
Identifier:N-(4-{[3-butyl-1-(2-fluorobenzyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}phenyl)acetamide
FTS
FTS
Name:(3R)-3-(FLUOROMETHYL)-N-(3,3,3-TRIFLUOROPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLINE-7-SULFONAMIDE
Formula:C13 H16 F4 N2 O2 S
SMILES:c2c1CNC(CF)Cc1ccc2S(=O)(=O)NCCC(F)(F)F
InChi:InChI=1S/C13H16F4N2O2S/c14-7-11-5-9-1-2-12(6-10(9)8-18-11)22(20,21)19-4-3-13(15,16)17/h1-2,6,11,18-19H,3-5,7-8H2/t11-/m1/s1
Synonyms:3(R)-FLUOROMETHYL 7-TRIFLUOROPROPYLSULFONAMIDE 1,2,3,4-TETRAHYDROISOQUINOLINE
Definition date:2006-03-03
Last modified:2020-06-17
Identifier:(3R)-3-(fluoromethyl)-N-(3,3,3-trifluoropropyl)-1,2,3,4-tetrahydroisoquinoline-7-sulfonamide
FVS
FVS
Name:(7beta,9beta,13alpha,17beta)-7-{9-[(R)-(4,4,5,5,5-pentafluoropentyl)sulfinyl]nonyl}estra-1(10),2,4-triene-3,17-diol
Formula:C32 H47 F5 O3 S
SMILES:FC(F)(F)C(F)(F)CCCS(=O)CCCCCCCCCC2Cc1c(ccc(O)c1)C3C2C4C(C)(CC3)C(O)CC4
InChi:InChI=1S/C32H47F5O3S/c1-30-17-15-26-25-12-11-24(38)21-23(25)20-22(29(26)27(30)13-14-28(30)39)10-7-5-3-2-4-6-8-18-41(40)19-9-16-31(33,34)32(35,36)37/h11-12,21-22,26-29,38-39H,2-10,13-20H2,1H3/t22-,26-,27+,28+,29-,30+,41-/m1/s1
Synonyms:Fulvestrant
Definition date:2013-02-25
Last modified:2020-06-17
Release date:2013-06-05
Identifier:(7beta,9beta,13alpha,17beta)-7-{9-[(R)-(4,4,5,5,5-pentafluoropentyl)sulfinyl]nonyl}estra-1(10),2,4-triene-3,17-diol
FW1
FW1
Name:Fusicoccin A aglycone
Formula:C23 H36 O6
SMILES:O=C(OCC(C2=C1C(O)C(O)C(C3C(=CC1(C)C(O)C2)C(CC3)COC)C)C)C
InChi:InChI=1S/C23H36O6/c1-12(10-29-14(3)24)17-8-19(25)23(4)9-18-15(11-28-5)6-7-16(18)13(2)21(26)22(27)20(17)23/h9,12-13,15-16,19,21-22,25-27H,6-8,10-11H2,1-5H3/b18-9-/t12-,13-,15-,16+,19+,21-,22-,23+/m1/s1
Synonyms:(2S)-2-[(1S,4R,5R,6R,6aS,9S,9aE,10aR)-1,4,5-trihydroxy-9-(methoxymethyl)-6,10a-dimethyl-1,2,4,5,6,6a,7,8,9,10a-decahydr odicyclopenta[a,d][8]annulen-3-yl]propyl acetate
Definition date:2011-07-06
Last modified:2020-06-17
Identifier:(2S)-2-[(1S,4R,5R,6R,6aS,9S,9aE,10aR)-1,4,5-trihydroxy-9-(methoxymethyl)-6,10a-dimethyl-1,2,4,5,6,6a,7,8,9,10a-decahydrodicyclopenta[a,d][8]annulen-3-yl]propyl acetate
FWD
FWD
Name:2-AMINO-3-(5-FLUORO-2,4-DIOXO-3,4-DIHYDRO-2H-PYRIMIDIN-1-YL)-PROPIONIC ACID
Formula:C7 H8 F N3 O4
SMILES:O=C(O)C(N)CN1C=C(F)C(=O)NC1=O
InChi:InChI=1S/C7H8FN3O4/c8-3-1-11(2-4(9)6(13)14)7(15)10-5(3)12/h1,4H,2,9H2,(H,13,14)(H,10,12,15)/t4-/m0/s1
Synonyms:FLUORO-WILLARDIINE
Definition date:2002-09-20
Last modified:2020-06-17
Identifier:3-(5-fluoro-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-L-alanine
MEL
MEL
Name:[((1R)-2-{(2S)-2-[({4-[AMINO(IMINO)METHYL]BENZYL}AMINO)CARBONYL]AZETIDINYL}-1-CYCLOHEXYL-2-OXOETHYL)AMINO]ACETIC ACID
Formula:C22 H31 N5 O4
SMILES:O=C(NCc1ccc(C(=[N@H])N)cc1)C3N(C(=O)C(NCC(=O)O)C2CCCCC2)CC3
InChi:InChI=1S/C22H31N5O4/c23-20(24)16-8-6-14(7-9-16)12-26-21(30)17-10-11-27(17)22(31)19(25-13-18(28)29)15-4-2-1-3-5-15/h6-9,15,17,19,25H,1-5,10-13H2,(H3,23,24)(H,26,30)(H,28,29)/t17-,19+/m0/s1
Synonyms:MELAGATRAN (ASTRA-ZENECA)
Definition date:2001-10-23
Last modified:2020-06-17
Identifier:N-[(1R)-2-{(2S)-2-[(4-carbamimidoylbenzyl)carbamoyl]azetidin-1-yl}-1-cyclohexyl-2-oxoethyl]glycine
MF3
MF3
Name:2-AMINO-4-TRIFLUOROMETHYLSULFANYL-BUTYRIC ACID
Formula:C5 H8 F3 N O2 S
SMILES:FC(F)(F)SCCC(N)C(=O)O
InChi:InChI=1S/C5H8F3NO2S/c6-5(7,8)12-2-1-3(9)4(10)11/h3H,1-2,9H2,(H,10,11)/t3-/m0/s1
Synonyms:TRIFLUOROMETHIONINE
Definition date:1999-07-27
Last modified:2020-06-17
Identifier:trifluoro-L-methionine
MF8
MF8
Name:Metformin
Formula:C4 H11 N5
SMILES:CN(C)C(=N)NC(N)=N
InChi:InChI=1S/C4H11N5/c1-9(2)4(7)8-3(5)6/h1-2H3,(H5,5,6,7,8)
Synonyms:N,N-Dimethylimidodicarbonimidic diamide
Definition date:2016-05-25
Last modified:2020-06-17
Release date:2017-06-07
Identifier:3-carbamimidoyl-1,1-dimethyl-guanidine
MG9
MG9
Name:2-{4-[(2S)-4-[(6-aminopyridin-3-yl)sulfonyl]-2-(prop-1-yn-1-yl)piperazin-1-yl]phenyl}-1,1,1,3,3,3-hexafluoropropan-2-ol
Formula:C21 H20 F6 N4 O3 S
SMILES:O=S(=O)(c1ccc(nc1)N)N3CC(C#CC)N(c2ccc(cc2)C(O)(C(F)(F)F)C(F)(F)F)CC3
InChi:InChI=1S/C21H20F6N4O3S/c1-2-3-16-13-30(35(33,34)17-8-9-18(28)29-12-17)10-11-31(16)15-6-4-14(5-7-15)19(32,20(22,23)24)21(25,26)27/h4-9,12,16,32H,10-11,13H2,1H3,(H2,28,29)/t16-/m0/s1
Synonyms:AMG-3969
Definition date:2013-10-02
Last modified:2020-06-17
Release date:2014-05-07
Identifier:2-{4-[(2S)-4-[(6-aminopyridin-3-yl)sulfonyl]-2-(prop-1-yn-1-yl)piperazin-1-yl]phenyl}-1,1,1,3,3,3-hexafluoropropan-2-ol
MGE
MGE
Name:(1S)-2-(ALPHA-L-ALLOPYRANOSYLOXY)-1-[(TRIDECANOYLOXY)METHYL]ETHYL PALMITATE
Formula:C38 H72 O10
SMILES:O=C(OCC(OC(=O)CCCCCCCCCCCCCCC)COC1OC(C(O)C(O)C1O)CO)CCCCCCCCCCCC
InChi:InChI=1S/C38H72O10/c1-3-5-7-9-11-13-15-16-17-19-21-23-25-27-34(41)47-31(30-46-38-37(44)36(43)35(42)32(28-39)48-38)29-45-33(40)26-24-22-20-18-14-12-10-8-6-4-2/h31-32,35-39,42-44H,3-30H2,1-2H3/t31-,32+,35+,36+,37+,38-/m1/s1
Synonyms:MONOGALACTOSYL-DIACYLGLYCEROL
Definition date:2005-10-03
Last modified:2020-06-17
Identifier:(1S)-2-(alpha-L-allopyranosyloxy)-1-[(tridecanoyloxy)methyl]ethyl hexadecanoate
MGH
MGH
Name:methyl N-(carboxymethyl)-N-(3-phenylpropanoyl)glycyl-D-histidinate
Formula:C20 H24 N4 O6
SMILES:O=C(O)CN(C(=O)CCc1ccccc1)CC(=O)NC(C(=O)OC)Cc2ncnc2
InChi:InChI=1S/C20H24N4O6/c1-30-20(29)16(9-15-10-21-13-22-15)23-17(25)11-24(12-19(27)28)18(26)8-7-14-5-3-2-4-6-14/h2-6,10,13,16H,7-9,11-12H2,1H3,(H,21,22)(H,23,25)(H,27,28)/t16-/m1/s1
Synonyms:(S)-2-{2-[Carboxymethyl-(3-phenyl-propionyl)-amino]-acetylamino}-3-(3H-imidazol-4-yl)-propionic acid methyl ester
Definition date:2011-03-24
Last modified:2020-06-17
Release date:2013-08-28
Identifier:methyl N-(carboxymethyl)-N-(3-phenylpropanoyl)glycyl-D-histidinate
MGI
MGI
Name:methyl 4-(2,3-dihydroxy-5-methylphenoxy)-2-hydroxy-6-methylbenzoate
Formula:C16 H16 O6
SMILES:O=C(OC)c2c(cc(Oc1cc(cc(O)c1O)C)cc2O)C
InChi:InChI=1S/C16H16O6/c1-8-4-12(18)15(19)13(5-8)22-10-6-9(2)14(11(17)7-10)16(20)21-3/h4-7,17-19H,1-3H3
Synonyms:methyl-gerfelin
Definition date:2007-09-30
Last modified:2020-06-17
Identifier:methyl 4-(2,3-dihydroxy-5-methylphenoxy)-2-hydroxy-6-methylbenzoate
MGM
MGM
Name:2-[METHYL-(5-GERANYL-4-METHYL-PENT-3-ENYL)-AMINO]-ETHYL-DIPHOSPHATE
Formula:C19 H37 N O7 P2
SMILES:O=P(OP(=O)(OCCN(C)CCC=C(/C)CCC=C(/C)CCC=C(/C)C)O)(O)O
InChi:InChI=1S/C19H37NO7P2/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-26-29(24,25)27-28(21,22)23/h9,11,13H,6-8,10,12,14-16H2,1-5H3,(H,24,25)(H2,21,22,23)/b18-11+,19-13+
Synonyms:3-AZAGERANYLGERANYL DIPHOSPHATE
Definition date:2002-11-20
Last modified:2020-06-17
Identifier:2-{methyl[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]amino}ethyl trihydrogen diphosphate
MGW
MGW
Name:methyl N-(carboxymethyl)-N-(2-phenylethyl)glycyl-L-histidinate
Formula:C19 H24 N4 O5
SMILES:O=C(O)CN(CCc1ccccc1)CC(=O)NC(C(=O)OC)Cc2cncn2
InChi:InChI=1S/C19H24N4O5/c1-28-19(27)16(9-15-10-20-13-21-15)22-17(24)11-23(12-18(25)26)8-7-14-5-3-2-4-6-14/h2-6,10,13,16H,7-9,11-12H2,1H3,(H,20,21)(H,22,24)(H,25,26)/t16-/m0/s1
Synonyms:( (S)-2-[2-(Carboxymethyl-phenethyl-amino)-acetylamino]-3-(1H-imidazol-4-yl)-propionic acid methyl ester
Definition date:2011-04-19
Last modified:2020-06-17
Release date:2013-08-28
Identifier:methyl N-(carboxymethyl)-N-(2-phenylethyl)glycyl-L-histidinate
MH2
MH2
Name:MANGANESE ION, 1 HYDROXYL COORDINATED
Formula:H Mn O
SMILES:[Mn+2]O
InChi:InChI=1S/Mn.H2O/h
Synonyms:[MN(OH)]+
Definition date:2002-06-26
Last modified:2020-06-17
Identifier:hydroxymanganese(2+)
MHN
MHN
Name:6-METHYLHEPTAN-1-OL
Formula:C8 H18 O
SMILES:OCCCCCC(C)C
InChi:InChI=1S/C8H18O/c1-8(2)6-4-3-5-7-9/h8-9H,3-7H2,1-2H3
Synonyms:METHYL HEPTANOL
Definition date:2003-04-14
Last modified:2020-06-17
Identifier:6-methylheptan-1-ol
1RZ
1RZ
Name:Lamivudine Triphosphate
Formula:C8 H14 N3 O12 P3 S
SMILES:NC1=NC(=O)N(C=C1)[CH]2CS[CH](CO[P](O)(=O)O[P](O)(=O)O[P](O)(O)=O)O2
InChi:InChI=1S/C8H14N3O12P3S/c9-5-1-2-11(8(12)10-5)6-4-27-7(21-6)3-20-25(16,17)23-26(18,19)22-24(13,14)15/h1-2,6-7H,3-4H2,(H,16,17)(H,18,19)(H2,9,10,12)(H2,13,14,15)/t6-,7+/m0/s1
Synonyms:Lamivudine-5'-triphosphate
Definition date:2013-05-14
Last modified:2020-06-17
Release date:2014-07-16
Identifier:[[(2R,5S)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-1,3-oxathiolan-2-yl]methoxy-oxidanyl-phosphoryl] phosphono hydrogen phosphate
MIY
MIY
Name:(4S,4AS,5AR,12AS)-4,7-BIS(DIMETHYLAMINO)-3,10,12,12A-TETRAHYDROXY-1,11-DIOXO-1,4,4A,5,5A,6,11,12A-OCTAHYDROTETRACENE-2- CARBOXAMIDE
Formula:C23 H27 N3 O7
SMILES:O=C(N)C1=C(O)C(N(C)C)C2CC4C(=C(O)C2(O)C1=O)C(=O)c3c(c(ccc3O)N(C)C)C4
InChi:InChI=1S/C23H27N3O7/c1-25(2)12-5-6-13(27)15-10(12)7-9-8-11-17(26(3)4)19(29)16(22(24)32)21(31)23(11,33)20(30)14(9)18(15)28/h5-6,9,11,17,27,29-30,33H,7-8H2,1-4H3,(H2,24,32)/t9-,11-,17-,23-/m0/s1
Synonyms:MINOCYCLINE
Definition date:2006-06-09
Last modified:2020-06-17
Identifier:(4S,4aS,5aR,12aS)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
MJA
MJA
Name:(3R,5R)-3,5-dihydroxy-7-[(1S,2S,6R,8S,8aR)-8-hydroxy-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]heptanoic acid
Formula:C19 H30 O5
SMILES:O=C(O)CC(O)CC(O)CCC2C(C=CC1=CC(CC(O)C12)C)C
InChi:InChI=1S/C19H30O5/c1-11-7-13-4-3-12(2)16(19(13)17(22)8-11)6-5-14(20)9-15(21)10-18(23)24/h3-4,7,11-12,14-17,19-22H,5-6,8-10H2,1-2H3,(H,23,24)/t11-,12-,14+,15+,16-,17-,19-/m0/s1
Synonyms:Monacolin J acid
Definition date:2009-06-18
Last modified:2020-06-17
Identifier:(3R,5R)-3,5-dihydroxy-7-[(1S,2S,6R,8S,8aR)-8-hydroxy-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]heptanoic acid
1SM
1SM
Name:METHYL 2-[({[(4,6-DIMETHYLPYRIMIDIN-2-YL)AMINO]CARBONYL}AMINO)SULFONYL]BENZOATE
Formula:C15 H16 N4 O5 S
SMILES:O=C(Nc1nc(cc(n1)C)C)NS(=O)(=O)c2ccccc2C(=O)OC
InChi:InChI=1S/C15H16N4O5S/c1-9-8-10(2)17-14(16-9)18-15(21)19-25(22,23)12-7-5-4-6-11(12)13(20)24-3/h4-8H,1-3H3,(H2,16,17,18,19,21)
Synonyms:SULFOMETURON METHYL
Definition date:2004-07-01
Last modified:2020-06-17
Identifier:methyl 2-{[(4,6-dimethylpyrimidin-2-yl)carbamoyl]sulfamoyl}benzoate
MJI
MJI
Name:1-HEXADECYL-3-TRIFLUOROETHYL-SN-GLYCERO-2-PHOSPHATE METHANE
Formula:C22 H44 F3 O6 P
SMILES:FC(F)(F)COCC(OP(=O)(OC)O)COCCCCCCCCCCCCCCCC
InChi:InChI=1S/C22H44F3O6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-29-18-21(31-32(26,27)28-2)19-30-20-22(23,24)25/h21H,3-20H2,1-2H3,(H,26,27)/t21-/m1/s1
Synonyms:MJ33 INHIBITOR
Definition date:2000-10-17
Last modified:2020-06-17
Identifier:(1R)-2-(hexadecyloxy)-1-[(2,2,2-trifluoroethoxy)methyl]ethyl methyl hydrogen (R)-phosphate

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