Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help
FD3
FD3
Name:N-ALPHA-(2-NAPHTHYLSULFONYL)-3-AMIDINO-L-PHENYLALANINE PIPERAZIDE
Formula:C24 H27 N5 O3 S
SMILES:O=C(N1CCNCC1)C(NS(=O)(=O)c3cc2ccccc2cc3)Cc4cc(C(=[N@H])N)ccc4
InChi:InChI=1S/C24H27N5O3S/c25-23(26)20-7-3-4-17(14-20)15-22(24(30)29-12-10-27-11-13-29)28-33(31,32)21-9-8-18-5-1-2-6-19(18)16-21/h1-9,14,16,22,27-28H,10-13,15H2,(H3,25,26)/t22-/m0/s1
Definition date:2001-10-19
Last modified:2011-06-04
Identifier:3-{(2S)-2-[(naphthalen-2-ylsulfonyl)amino]-3-oxo-3-piperazin-1-ylpropyl}benzenecarboximidamide
FD8
FD8
Name:N-[3-(pentafluorophenoxy)phenyl]-2-(trifluoromethyl)benzamide
Formula:C20 H9 F8 N O2
SMILES:Fc1c(F)c(F)c(Oc2cccc(NC(=O)c3ccccc3C(F)(F)F)c2)c(F)c1F
InChi:InChI=1S/C20H9F8NO2/c21-13-14(22)16(24)18(17(25)15(13)23)31-10-5-3-4-9(8-10)29-19(30)11-6-1-2-7-12(11)20(26,27)28/h1-8H,(H,29,30)
Definition date:2010-02-22
Last modified:2011-06-04
Identifier:N-[3-(2,3,4,5,6-pentafluorophenoxy)phenyl]-2-(trifluoromethyl)benzamide
FDF
FDF
Name:(2E,6E)-12-fluoro-11-(fluoromethyl)-3,7-dimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate
Formula:C15 H26 F2 O7 P2
SMILES:FC/C(=CCCC(=CCC/C(=C/COP(=O)(OP(=O)(O)O)O)C)C)CF
InChi:InChI=1S/C15H26F2O7P2/c1-13(7-4-8-15(11-16)12-17)5-3-6-14(2)9-10-23-26(21,22)24-25(18,19)20/h5,8-9H,3-4,6-7,10-12H2,1-2H3,(H,21,22)(H2,18,19,20)/b13-5+,14-9+
Definition date:2008-03-20
Last modified:2011-06-04
Identifier:(2E,6E)-12-fluoro-11-(fluoromethyl)-3,7-dimethyldodeca-2,6,10-trien-1-yl trihydrogen diphosphate
FDG
FDG
Name:2-amino-9-(2-deoxy-2-fluoro-5-O-phosphono-beta-D-arabinofuranosyl)-7,9-dihydro-1H-purine-6,8-dione
Formula:C10 H13 F N5 O8 P
SMILES:O=P(O)(O)OCC3OC(N2C(=O)NC1=C2N=C(N)NC1=O)C(F)C3O
InChi:InChI=1S/C10H13FN5O8P/c11-3-5(17)2(1-23-25(20,21)22)24-8(3)16-6-4(13-10(16)19)7(18)15-9(12)14-6/h2-3,5,8,17H,1H2,(H,13,19)(H2,20,21,22)(H3,12,14,15,18)/t2-,3+,5-,8-/m1/s1
Definition date:2010-01-06
Last modified:2011-06-04
Identifier:2-amino-9-(2-deoxy-2-fluoro-5-O-phosphono-beta-D-arabinofuranosyl)-7,9-dihydro-1H-purine-6,8-dione
FDI
FDI
Name:4-(N-ACETYLAMINO)-3-[N-(2-ETHYLBUTANOYLAMINO)]BENZOIC ACID
Formula:C15 H20 N2 O4
SMILES:O=C(Nc1cc(ccc1NC(=O)C)C(=O)O)C(CC)CC
InChi:InChI=1S/C15H20N2O4/c1-4-10(5-2)14(19)17-13-8-11(15(20)21)6-7-12(13)16-9(3)18/h6-8,10H,4-5H2,1-3H3,(H,16,18)(H,17,19)(H,20,21)
Definition date:1999-07-08
Last modified:2011-06-04
Identifier:4-(acetylamino)-3-[(2-ethylbutanoyl)amino]benzoic acid
FDS
FDS
Name:FLUORESCIN
Formula:C20 H14 O5
SMILES:O=C(O)c1ccccc1C3c4c(Oc2c3ccc(O)c2)cc(O)cc4
InChi:InChI=1S/C20H14O5/c21-11-5-7-15-17(9-11)25-18-10-12(22)6-8-16(18)19(15)13-3-1-2-4-14(13)20(23)24/h1-10,19,21-22H,(H,23,24)
Definition date:1999-07-08
Last modified:2011-06-04
Identifier:2-(3,6-dihydroxy-9H-xanthen-9-yl)benzoic acid
FEE
FEE
Name:N-{(1S,2S,3R)-1-[(alpha-D-galactopyranosyloxy)methyl]-2,3-dihydroxyoctyl}tetracosanamide
Formula:C39 H77 N O9
SMILES:O=C(NC(COC1OC(C(O)C(O)C1O)CO)C(O)C(O)CCCCC)CCCCCCCCCCCCCCCCCCCCCCC
InChi:InChI=1S/C39H77NO9/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-28-34(43)40-31(35(44)32(42)27-25-6-4-2)30-48-39-38(47)37(46)36(45)33(29-41)49-39/h31-33,35-39,41-42,44-47H,3-30H2,1-2H3,(H,40,43)/t31-,32+,33+,35-,36-,37-,38+,39-/m0/s1
Definition date:2009-02-09
Last modified:2011-06-04
Identifier:N-{(1S,2S,3R)-1-[(alpha-D-galactopyranosyloxy)methyl]-2,3-dihydroxyoctyl}tetracosanamide
FEF
FEF
Name:(2Z,3E)-2,3'-BIINDOLE-2',3(1H,1'H)-DIONE 3-{O-[(3R)-3,4-DIHYDROXYBUTYL]OXIME}
Formula:C20 H19 N3 O4
SMILES:O=C2C(c1ccccc1N2)=C4C(=NOCCC(O)CO)c3ccccc3N4
InChi:InChI=1S/C20H19N3O4/c24-11-12(25)9-10-27-23-18-14-6-2-4-8-16(14)21-19(18)17-13-5-1-3-7-15(13)22-20(17)26/h1-8,12,21,24-25H,9-11H2,(H,22,26)/b19-17-,23-18+/t12-/m1/s1
Definition date:2008-07-30
Last modified:2011-06-04
Identifier:(2Z,3E)-2,3'-biindole-2',3(1H,1'H)-dione 3-{O-[(3R)-3,4-dihydroxybutyl]oxime}
FFD
FFD
Name:(1R)-1,4-anhydro-2-deoxy-1-(3-fluorophenyl)-5-O-phosphono-D-erythro-pentitol
Formula:C11 H14 F O6 P
SMILES:O=P(OCC2OC(c1cccc(F)c1)CC2O)(O)O
InChi:InChI=1S/C11H14FO6P/c12-8-3-1-2-7(4-8)10-5-9(13)11(18-10)6-17-19(14,15)16/h1-4,9-11,13H,5-6H2,(H2,14,15,16)/t9-,10+,11+/m0/s1
Definition date:2007-04-16
Last modified:2011-06-04
Identifier:(1R)-1,4-anhydro-2-deoxy-1-(3-fluorophenyl)-5-O-phosphono-D-erythro-pentitol
FFM
FFM
Name:S-[(1R,2R)-2-hydroxy-1-methyl-2-phosphonoethyl]-L-cysteine
Formula:C6 H14 N O6 P S
SMILES:C[CH](SC[CH](N)C(O)=O)[CH](O)[P](O)(O)=O
InChi:InChI=1S/C6H14NO6PS/c1-3(6(10)14(11,12)13)15-2-4(7)5(8)9/h3-4,6,10H,2,7H2,1H3,(H,8,9)(H2,11,12,13)/t3-,4+,6-/m1/s1
Definition date:2009-12-08
Last modified:2011-06-04
Identifier:(2R)-2-azanyl-3-[(1R,2R)-1-hydroxy-1-phosphono-propan-2-yl]sulfanyl-propanoic acid
FFP
FFP
Name:2,6-DIFLUOROPHENOL
Formula:C6 H4 F2 O
SMILES:Fc1cccc(F)c1O
InChi:InChI=1S/C6H4F2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H
Definition date:2006-10-10
Last modified:2011-06-04
Identifier:2,6-difluorophenol
FG1
FG1
Name:N-[4-(2-{2-[3-(2-BROMO-ACETYLAMINO)-PROPIONYLAMINO]-3-HYDROXY-PROPIONYLAMINO}-ETHYL)-PHENYL]-OXALAMIC ACID
Formula:C18 H23 Br N4 O7
SMILES:O=C(Nc1ccc(cc1)CCNC(=O)C(NC(=O)CCNC(=O)CBr)CO)C(=O)O
InChi:InChI=1S/C18H23BrN4O7/c19-9-15(26)20-8-6-14(25)23-13(10-24)16(27)21-7-5-11-1-3-12(4-2-11)22-17(28)18(29)30/h1-4,13,24H,5-10H2,(H,20,26)(H,21,27)(H,22,28)(H,23,25)(H,29,30)/t13-/m0/s1
Definition date:2003-04-23
Last modified:2011-06-04
Identifier:N-(bromoacetyl)-beta-alanyl-N-(2-{4-[(carboxycarbonyl)amino]phenyl}ethyl)-L-serinamide
FGR
FGR
Name:N-(N-FORMYLGLYCYL)-5-O-PHOSPHONO-BETA-D-RIBOFURANOSYLAMINE
Formula:C8 H15 N2 O9 P
SMILES:O=C(NC1OC(C(O)C1O)COP(=O)(O)O)CNC=O
InChi:InChI=1S/C8H15N2O9P/c11-3-9-1-5(12)10-8-7(14)6(13)4(19-8)2-18-20(15,16)17/h3-4,6-8,13-14H,1-2H2,(H,9,11)(H,10,12)(H2,15,16,17)/t4-,6-,7-,8-/m1/s1
Definition date:2006-07-26
Last modified:2011-06-04
Identifier:N-(N-formylglycyl)-5-O-phosphono-beta-D-ribofuranosylamine
FGS
FGS
Name:5-(ACETYLAMINO)-5-DEOXY-1-O-PHOSPHONO-L-IDITOL
Formula:C8 H18 N O9 P
SMILES:O=P(O)(O)OCC(O)C(O)C(O)C(NC(=O)C)CO
InChi:InChI=1S/C8H18NO9P/c1-4(11)9-5(2-10)7(13)8(14)6(12)3-18-19(15,16)17/h5-8,10,12-14H,2-3H2,1H3,(H,9,11)(H2,15,16,17)/t5-,6-,7+,8+/m0/s1
Definition date:2009-09-25
Last modified:2011-06-04
Identifier:5-(acetylamino)-5-deoxy-1-O-phosphono-L-iditol
FHB
FHB
Name:3-FLUORO-4-HYDROXYBENZOIC ACID
Formula:C7 H5 F O3
SMILES:Fc1cc(C(=O)O)ccc1O
InChi:InChI=1S/C7H5FO3/c8-5-3-4(7(10)11)1-2-6(5)9/h1-3,9H,(H,10,11)
Definition date:1999-07-08
Last modified:2011-06-04
Identifier:3-fluoro-4-hydroxybenzoic acid
FHM
FHM
Name:S-3-(4-FLUOROPHENOXY)-2-HYDROXY-2-METHYL-N-[4-NITRO-3-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE
Formula:C17 H14 F4 N2 O5
SMILES:FC(F)(F)c1cc(ccc1[N+]([O-])=O)NC(=O)C(O)(COc2ccc(F)cc2)C
InChi:InChI=1S/C17H14F4N2O5/c1-16(25,9-28-12-5-2-10(18)3-6-12)15(24)22-11-4-7-14(23(26)27)13(8-11)17(19,20)21/h2-8,25H,9H2,1H3,(H,22,24)/t16-/m0/s1
Definition date:2005-09-08
Last modified:2011-06-04
Identifier:(2S)-3-(4-fluorophenoxy)-2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide
FHN
FHN
Name:(2S,3R,5R,6S)-3,4,5-TRIHYDROXY-2,6-BIS(HYDROXYMETHYL)PIPERIDINIUM
Formula:C7 H16 N O5
SMILES:OC1C(CO)[NH2+]C(C(O)C1O)CO
InChi:InChI=1S/C7H15NO5/c9-1-3-5(11)7(13)6(12)4(2-10)8-3/h3-13H,1-2H2/p+1/t3-,4-,5+,6+/m0/s1
Definition date:2009-10-20
Last modified:2011-06-04
Identifier:(2S,3R,5R,6S)-3,4,5-trihydroxy-2,6-bis(hydroxymethyl)piperidinium
FHU
FHU
Name:(5S,6R)-5-FLUORO-6-HYDROXY-PSEUDOURIDINE-5'-MONOPHOSPHATE
Formula:C9 H14 F N2 O10 P
SMILES:O=P(OCC1OC(C(O)C1O)C2(F)C(=O)NC(=O)NC2O)(O)O
InChi:InChI=1S/C9H14FN2O10P/c10-9(6(15)11-8(17)12-7(9)16)5-4(14)3(13)2(22-5)1-21-23(18,19)20/h2-6,13-15H,1H2,(H2,18,19,20)(H2,11,12,16,17)/t2-,3-,4-,5-,6-,9+/m1/s1
Definition date:2001-11-02
Last modified:2011-06-04
Identifier:(1R)-1,4-anhydro-1-[(4R,5S)-5-fluoro-4-hydroxy-2,6-dioxohexahydropyrimidin-5-yl]-5-O-phosphono-D-ribitol
FIC
FIC
Name:5-fluoroindole-2-carboxylic acid
Formula:C9 H6 F N O2
SMILES:Fc1cc2c(cc1)nc(c2)C(=O)O
InChi:InChI=1S/C9H6FNO2/c10-6-1-2-7-5(3-6)4-8(11-7)9(12)13/h1-4,11H,(H,12,13)
Definition date:2008-07-25
Last modified:2011-06-04
Identifier:5-fluoro-1H-indole-2-carboxylic acid
FIN
FIN
Name:(1R)-1-{[(4'-METHOXY-1,1'-BIPHENYL-4-YL)SULFONYL]AMINO}-2-METHYLPROPYLPHOSPHONIC ACID
Formula:C17 H22 N O6 P S
SMILES:O=P(O)(O)C(NS(=O)(=O)c2ccc(c1ccc(OC)cc1)cc2)C(C)C
InChi:InChI=1S/C17H22NO6PS/c1-12(2)17(25(19,20)21)18-26(22,23)16-10-6-14(7-11-16)13-4-8-15(24-3)9-5-13/h4-12,17-18H,1-3H3,(H2,19,20,21)/t17-/m1/s1
Definition date:2005-06-07
Last modified:2011-06-04
Identifier:[(1R)-1-{[(4'-methoxybiphenyl-4-yl)sulfonyl]amino}-2-methylpropyl]phosphonic acid
FJZ
FJZ
Name:N-cyclohexyl-4-(1H-imidazol-5-yl)piperidine-1-carbothioamide
Formula:C15 H24 N4 S
SMILES:S=C(NC1CCCCC1)N3CCC(c2cncn2)CC3
InChi:InChI=1S/C15H24N4S/c20-15(18-13-4-2-1-3-5-13)19-8-6-12(7-9-19)14-10-16-11-17-14/h10-13H,1-9H2,(H,16,17)(H,18,20)
Definition date:2010-04-01
Last modified:2011-06-04
Identifier:N-cyclohexyl-4-(1H-imidazol-5-yl)piperidine-1-carbothioamide
8ST
8ST
Name:N-(4-chlorophenyl)-2-[(pyridin-4-ylmethyl)amino]benzamide
Formula:C19 H16 Cl N3 O
SMILES:Clc1ccc(cc1)NC(=O)c3c(NCc2ccncc2)cccc3
InChi:InChI=1S/C19H16ClN3O/c20-15-5-7-16(8-6-15)23-19(24)17-3-1-2-4-18(17)22-13-14-9-11-21-12-10-14/h1-12,22H,13H2,(H,23,24)
Definition date:2009-06-01
Last modified:2011-06-04
Identifier:N-(4-chlorophenyl)-2-[(pyridin-4-ylmethyl)amino]benzamide
8XQ
8XQ
Name:8-hydroxyquinoline-5-carboxylic acid
Formula:C10 H7 N O3
SMILES:O=C(O)c1ccc(O)c2ncccc12
InChi:InChI=1S/C10H7NO3/c12-8-4-3-7(10(13)14)6-2-1-5-11-9(6)8/h1-5,12H,(H,13,14)
Definition date:2010-07-05
Last modified:2011-06-04
Identifier:8-hydroxyquinoline-5-carboxylic acid
902
902
Name:{[5-(3-{[1-(BENZYLSULFONYL)PIPERIDIN-4-YL]AMINO}PHENYL)-4-BROMO-2-(2H-TETRAZOL-5-YL)-3-THIENYL]OXY}ACETIC ACID
Formula:C25 H25 Br N6 O5 S2
SMILES:O=S(=O)(N4CCC(Nc1cccc(c1)c2sc(c(OCC(=O)O)c2Br)c3nnnn3)CC4)Cc5ccccc5
InChi:InChI=1S/C25H25BrN6O5S2/c26-21-22(37-14-20(33)34)24(25-28-30-31-29-25)38-23(21)17-7-4-8-19(13-17)27-18-9-11-32(12-10-18)39(35,36)15-16-5-2-1-3-6-16/h1-8,13,18,27H,9-12,14-15H2,(H,33,34)(H,28,29,30,31)
Definition date:2006-11-09
Last modified:2011-06-04
Identifier:{[5-(3-{[1-(benzylsulfonyl)piperidin-4-yl]amino}phenyl)-4-bromo-2-(2H-tetrazol-5-yl)thiophen-3-yl]oxy}acetic acid
910
910
Name:5-[3-(BENZYLAMINO)PHENYL]-4-BROMO-3-(CARBOXYMETHOXY)THIOPHENE-2-CARBOXYLIC ACID
Formula:C20 H16 Br N O5 S
SMILES:O=C(O)c3sc(c1cc(ccc1)NCc2ccccc2)c(Br)c3OCC(=O)O
InChi:InChI=1S/C20H16BrNO5S/c21-16-17(27-11-15(23)24)19(20(25)26)28-18(16)13-7-4-8-14(9-13)22-10-12-5-2-1-3-6-12/h1-9,22H,10-11H2,(H,23,24)(H,25,26)
Definition date:2006-06-20
Last modified:2011-06-04
Identifier:5-[3-(benzylamino)phenyl]-4-bromo-3-(carboxymethoxy)thiophene-2-carboxylic acid

223532

數據於2024-08-07公開中

PDB statisticsPDBj update infoContact PDBjnumon