Loading
PDBj
MenuPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDBDonate
RCSB PDBPDBeBMRBAdv. SearchSearch help
FOS
FOS
Name:[[N-(BENZYLOXYCARBONYL)AMINO]METHYL]PHOSPHATE
Formula:C9 H12 N O5 P
SMILES:O=P(O)(O)CNC(=O)OCc1ccccc1
InChi:InChI=1S/C9H12NO5P/c11-9(10-7-16(12,13)14)15-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)(H2,12,13,14)
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:({[(benzyloxy)carbonyl]amino}methyl)phosphonic acid
FP5
FP5
Name:PHENYLACETAMIDOMETHYL BORONIC ACID
Formula:C9 H12 B N O3
SMILES:OB(O)CNC(=O)Cc1ccccc1
InChi:InChI=1S/C9H12BNO3/c12-9(11-7-10(13)14)6-8-4-2-1-3-5-8/h1-5,13-14H,6-7H2,(H,11,12)
Definition date:2011-01-12
Last modified:2024-09-27
Identifier:(2-phenylethanoylamino)methylboronic acid
FP6
FP6
Name:pyrrolidine-1-carbaldehyde
Formula:C5 H9 N O
SMILES:O=CN1CCCC1
InChi:InChI=1S/C5H9NO/c7-5-6-3-1-2-4-6/h5H,1-4H2
Definition date:2011-03-22
Last modified:2024-09-27
Identifier:pyrrolidine-1-carbaldehyde
FP7
FP7
Name:5-(3,5-dimethyl-1,2-oxazol-4-yl)-1-({4-[(1R)-1-hydroxyethyl]phenyl}methyl)pyridin-2(1H)-one
Formula:C19 H20 N2 O3
SMILES:c3cc(CN2C=C(c1c(C)noc1C)C=CC2=O)ccc3C(C)O
InChi:InChI=1S/C19H20N2O3/c1-12-19(14(3)24-20-12)17-8-9-18(23)21(11-17)10-15-4-6-16(7-5-15)13(2)22/h4-9,11,13,22H,10H2,1-3H3/t13-/m1/s1
Definition date:2018-04-11
Last modified:2024-09-27
Release date:2018-09-26
Identifier:5-(3,5-dimethyl-1,2-oxazol-4-yl)-1-({4-[(1R)-1-hydroxyethyl]phenyl}methyl)pyridin-2(1H)-one
FP8
FP8
Name:(1R,2S)-1-hydroxy-2-[(N-{[(2-methyl-2-azaspiro[3.3]heptan-6-yl)oxy]carbonyl}-L-leucyl)amino]-3-[(3S)-2-oxopyrrolidin-3-yl]propane-1-sulfonic acid
Formula:C28 H40 N4 O9 S
SMILES:O=C(Cc1ccccc1)N1CC2(CC(C2)OC(=O)NC(CC(C)C)C(=O)NC(CC2CCNC2=O)C(O)S(=O)(=O)O)C1
InChi:InChI=1S/C28H40N4O9S/c1-17(2)10-21(25(35)30-22(26(36)42(38,39)40)12-19-8-9-29-24(19)34)31-27(37)41-20-13-28(14-20)15-32(16-28)23(33)11-18-6-4-3-5-7-18/h3-7,17,19-22,26,36H,8-16H2,1-2H3,(H,29,34)(H,30,35)(H,31,37)(H,38,39,40)/t19-,21-,22-,26+/m0/s1
Definition date:2021-12-15
Last modified:2024-09-27
Release date:2021-12-22
Identifier:(1R,2S)-1-hydroxy-3-[(3S)-2-oxopyrrolidin-3-yl]-2-{[N-({[2-(phenylacetyl)-2-azaspiro[3.3]heptan-6-yl]oxy}carbonyl)-L-leucyl]amino}propane-1-sulfonic acid
FP9
FP9
Name:(4R)-4-fluoro-L-proline
Formula:C5 H8 F N O2
SMILES:O=C(O)C1NCC(F)C1
InChi:InChI=1S/C5H8FNO2/c6-3-1-4(5(8)9)7-2-3/h3-4,7H,1-2H2,(H,8,9)/t3-,4+/m1/s1
Definition date:2009-08-18
Last modified:2024-09-27
Identifier:(4R)-4-fluoro-L-proline
FPA
FPA
Name:bromo(difluoro)acetic acid
Formula:C2 H Br F2 O2
SMILES:C(F)(F)(C(=O)O)Br
InChi:InChI=1S/C2HBrF2O2/c3-2(4,5)1(6)7/h(H,6,7)
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:bromo(difluoro)acetic acid
FPJ
FPJ
Name:5'-O-[(R)-hydroxy(propanoylamino)phosphoryl]adenosine
Formula:C13 H19 N6 O7 P
SMILES:c2n(c1c(c(ncn1)N)n2)C3C(C(O)C(COP(NC(=O)CC)(O)=O)O3)O
InChi:InChI=1S/C13H19N6O7P/c1-2-7(20)18-27(23,24)25-3-6-9(21)10(22)13(26-6)19-5-17-8-11(14)15-4-16-12(8)19/h4-6,9-10,13,21-22H,2-3H2,1H3,(H2,14,15,16)(H2,18,20,23,24)/t6-,9-,10-,13-/m1/s1
Definition date:2018-04-11
Last modified:2024-09-27
Release date:2018-08-08
Identifier:5'-O-[(R)-hydroxy(propanoylamino)phosphoryl]adenosine
FPK
FPK
Name:1-formyl-L-proline
Formula:C6 H9 N O3
SMILES:O=CN1C(C(=O)O)CCC1
InChi:InChI=1S/C6H9NO3/c8-4-7-3-1-2-5(7)6(9)10/h4-5H,1-3H2,(H,9,10)/t5-/m0/s1
Definition date:2012-10-08
Last modified:2024-09-27
Release date:2013-05-29
Identifier:1-formyl-L-proline
FPR
FPR
Name:(3S)-3-amino-4-oxo-7-phenylheptanoic acid
Formula:C13 H17 N O3
SMILES:O=C(O)CC(N)C(=O)CCCc1ccccc1
InChi:InChI=1S/C13H17NO3/c14-11(9-13(16)17)12(15)8-4-7-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9,14H2,(H,16,17)/t11-/m0/s1
Definition date:2003-11-19
Last modified:2024-09-27
Identifier:(3S)-3-amino-4-oxo-7-phenylheptanoic acid
FQA
FQA
Name:N~6~-benzyl-L-lysine
Formula:C13 H20 N2 O2
SMILES:NC(C(O)=O)CCCCNCc1ccccc1
InChi:InChI=1S/C13H20N2O2/c14-12(13(16)17)8-4-5-9-15-10-11-6-2-1-3-7-11/h1-3,6-7,12,15H,4-5,8-10,14H2,(H,16,17)/t12-/m0/s1
Definition date:2018-04-12
Last modified:2024-09-27
Release date:2019-04-10
Identifier:N~6~-benzyl-L-lysine
FQZ
FQZ
Name:(1~{R},3~{S},4~{R},5~{R})-3-methyl-4,5-bis(hydroxyl)cyclohexane-1-carboxylic acid
Formula:C8 H14 O4
SMILES:C[CH]1C[CH](C[CH](O)[CH]1O)C(O)=O
InChi:InChI=1S/C8H14O4/c1-4-2-5(8(11)12)3-6(9)7(4)10/h4-7,9-10H,2-3H2,1H3,(H,11,12)/t4-,5+,6+,7+/m0/s1
Definition date:2018-07-25
Last modified:2024-09-27
Release date:2019-07-24
Identifier:(1~{R},3~{S},4~{R},5~{R})-3-methyl-4,5-bis(oxidanyl)cyclohexane-1-carboxylic acid
FR1
FR1
Name:2-[4-[[(S)-1-[[(S)-2-[[(RS)-3,3,3-TRIFLUORO-1-ISOPROPYL-2-OXOPROPYL]AMINOCARBONYL]PYRROLIDIN-1-YL-]CARBONYL]-2-METHYLPROPYL]AMINOCARBONYL]BENZOYLAMINO]ACETIC ACID
Formula:C26 H33 F3 N4 O7
SMILES:O=C(NC(C(=O)C(F)(F)F)C(C)C)C2N(C(=O)C(NC(=O)c1ccc(C(=O)NCC(=O)O)cc1)C(C)C)CCC2
InChi:InChI=1S/C26H33F3N4O7/c1-13(2)19(21(36)26(27,28)29)31-24(39)17-6-5-11-33(17)25(40)20(14(3)4)32-23(38)16-9-7-15(8-10-16)22(37)30-12-18(34)35/h7-10,13-14,17,19-20H,5-6,11-12H2,1-4H3,(H,30,37)(H,31,39)(H,32,38)(H,34,35)/t17-,19-,20-/m0/s1
Definition date:2002-09-06
Last modified:2024-09-27
Identifier:N-({4-[(carboxymethyl)carbamoyl]phenyl}carbonyl)-L-valyl-N-[(1S)-3,3,3-trifluoro-1-(1-methylethyl)-2-oxopropyl]-L-prolinamide
FRD
FRD
Name:1-PHENYL-2-AMINOPROPANE
Formula:C9 H13 N
SMILES:NC(Cc1ccccc1)C
InChi:InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3/t8-/m1/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:(2R)-1-phenylpropan-2-amine
FRW
FRW
Name:4-[[(2S)-3-methyl-1-oxo-1-[(2S)-2-[[(3S)-1,1,1-trifluoro-4-methyl-2-oxo-pentan-3-yl]carbamoyl]pyrrolidin-1-yl]butan-2-yl]carbamoyl]benzoic acid
Formula:C24 H30 F3 N3 O6
SMILES:O=C(NC(C(=O)C(F)(F)F)C(C)C)C2N(C(=O)C(NC(=O)c1ccc(C(=O)O)cc1)C(C)C)CCC2
InChi:InChI=1S/C24H30F3N3O6/c1-12(2)17(19(31)24(25,26)27)28-21(33)16-6-5-11-30(16)22(34)18(13(3)4)29-20(32)14-7-9-15(10-8-14)23(35)36/h7-10,12-13,16-18H,5-6,11H2,1-4H3,(H,28,33)(H,29,32)(H,35,36)/t16-,17-,18-/m0/s1
Definition date:2009-05-26
Last modified:2024-09-27
Identifier:N-[(4-carboxyphenyl)carbonyl]-L-valyl-N-[(1S)-3,3,3-trifluoro-1-(1-methylethyl)-2-oxopropyl]-L-prolinamide
FSH
FSH
Name: (2R,3S,4S)-5-[(4R)-6',7'-dimethyl-2,3',5-trioxo-1'H-spiro[imidazolidine-4,2'-quinoxalin]-4'(3'H)-yl]-2,3,4-trihydroxypentyl-adenosine diphosphate
Formula:C27 H35 N9 O16 P2
SMILES:O=C1NC(=O)NC13Nc2cc(c(cc2N(C3=O)CC(O)C(O)C(O)COP(=O)(O)OP(=O)(O)OCC6OC(n5cnc4c(ncnc45)N)C(O)C6O)C)C
InChi:InChI=1S/C27H35N9O16P2/c1-10-3-12-13(4-11(10)2)35(25(43)27(33-12)24(42)32-26(44)34-27)5-14(37)18(39)15(38)6-49-53(45,46)52-54(47,48)50-7-16-19(40)20(41)23(51-16)36-9-31-17-21(28)29-8-30-22(17)36/h3-4,8-9,14-16,18-20,23,33,37-41H,5-7H2,1-2H3,(H,45,46)(H,47,48)(H2,28,29,30)(H2,32,34,42,44)/t14-,15+,16+,18-,19+,20+,23+,27+/m0/s1
Definition date:2008-06-04
Last modified:2024-09-27
Identifier:[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl (2R,3S,4S)-5-[(4R)-6',7'-dimethyl-2,3',5-trioxo-1'H-spiro[imidazolidine-4,2'-quinoxalin]-4'(3'H)-yl]-2,3,4-trihydroxypentyl dihydrogen diphosphate (non-preferred name)
FSI
FSI
Name:5-acetamido-3,5-dideoxy-3-fluoro-D-erythro-alpha-L-manno-non-2-ulopyranosonic acid
Formula:C11 H18 F N O9
SMILES:O=C(O)C1(O)OC(C(NC(=O)C)C(O)C1F)C(O)C(O)CO
InChi:InChI=1S/C11H18FNO9/c1-3(15)13-5-7(18)9(12)11(21,10(19)20)22-8(5)6(17)4(16)2-14/h4-9,14,16-18,21H,2H2,1H3,(H,13,15)(H,19,20)/t4-,5-,6-,7-,8-,9-,11+/m1/s1
Synonyms:5-(acetylamino)-3,5-dideoxy-3-fluoro-D-erythro-alpha-L-manno-non-2-ulopyranosonic acid
Definition date:2004-01-19
Last modified:2024-09-27
Identifier:5-(acetylamino)-3,5-dideoxy-3-fluoro-D-erythro-alpha-L-manno-non-2-ulopyranosonic acid
FSL
FSL
Name:(2R)-2-phenylbutanedioic acid
Formula:C10 H10 O4
SMILES:O=C(O)C(c1ccccc1)CC(=O)O
InChi:InChI=1S/C10H10O4/c11-9(12)6-8(10(13)14)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,11,12)(H,13,14)/t8-/m1/s1
Definition date:2014-07-23
Last modified:2024-09-27
Release date:2014-08-20
Identifier:(2R)-2-phenylbutanedioic acid
FSP
FSP
Name:[1-(4-FLUOROBENZYL)CYCLOBUTYL]METHYL (1S)-1-[OXO(1H-PYRAZOL-5-YLAMINO)ACETYL]PENTYLCARBAMATE
Formula:C23 H29 F N4 O4
SMILES:O=C(C(=O)C(NC(=O)OCC2(Cc1ccc(F)cc1)CCC2)CCCC)Nc3ccnn3
InChi:InChI=1S/C23H29FN4O4/c1-2-3-5-18(20(29)21(30)27-19-10-13-25-28-19)26-22(31)32-15-23(11-4-12-23)14-16-6-8-17(24)9-7-16/h6-10,13,18H,2-5,11-12,14-15H2,1H3,(H,26,31)(H2,25,27,28,30)/t18-/m0/s1
Definition date:2004-07-12
Last modified:2024-09-27
Identifier:[1-(4-fluorobenzyl)cyclobutyl]methyl {(1S)-1-[oxo(1H-pyrazol-5-ylamino)acetyl]pentyl}carbamate
FSQ
FSQ
Name:(1~{S},3~{R},4~{S},5~{R})-3-methyl-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic Acid
Formula:C8 H14 O5
SMILES:C[C]1(O)C[CH](C[CH](O)[CH]1O)C(O)=O
InChi:InChI=1S/C8H14O5/c1-8(13)3-4(7(11)12)2-5(9)6(8)10/h4-6,9-10,13H,2-3H2,1H3,(H,11,12)/t4-,5+,6-,8+/m0/s1
Definition date:2018-07-25
Last modified:2024-09-27
Release date:2019-07-24
Identifier:(1~{S},3~{R},4~{S},5~{R})-3-methyl-3,4,5-tris(oxidanyl)cyclohexane-1-carboxylic acid
FSR
FSR
Name:(2S,3S,4R,5R,6R)-5-acetamido-2,3-bis(fluoranyl)-4-oxidanyl-6-[(1S,2S)-1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic acid
Formula:C11 H17 F2 N O8
SMILES:FC1(OC(C(NC(=O)C)C(O)C1F)C(O)C(O)CO)C(=O)O
InChi:InChI=1S/C11H17F2NO8/c1-3(16)14-5-7(19)9(12)11(13,10(20)21)22-8(5)6(18)4(17)2-15/h4-9,15,17-19H,2H2,1H3,(H,14,16)(H,20,21)/t4-,5+,6-,7+,8+,9-,11+/m0/s1
Synonyms:2,3-difluorosialic acid
Definition date:2013-10-28
Last modified:2024-09-27
Release date:2013-12-25
Identifier:(2R,3S,4R,5R,6R)-5-(acetylamino)-2,3-difluoro-4-hydroxy-6-[(1S,2S)-1,2,3-trihydroxypropyl]tetrahydro-2H-pyran-2-carboxy lic acid (non-preferred name)
FT5
FT5
Name:(3~{R})-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid
Formula:C7 H12 O5
SMILES:O[CH]1C[CH](C[CH](O)[CH]1O)C(O)=O
InChi:InChI=1S/C7H12O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h3-6,8-10H,1-2H2,(H,11,12)/t3-,4+,5-,6-
Definition date:2018-07-25
Last modified:2024-09-27
Release date:2019-07-24
Identifier:(3~{R})-3,4,5-tris(oxidanyl)cyclohexane-1-carboxylic acid
FT6
FT6
Name:6-FLUORO-L-TRYPTOPHAN
Formula:C11 H11 F N2 O2
SMILES:O=C(O)C(N)Cc2c1ccc(F)cc1nc2
InChi:InChI=1S/C11H11FN2O2/c12-7-1-2-8-6(3-9(13)11(15)16)5-14-10(8)4-7/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m0/s1
Synonyms:(S)-2-AMINO-3-(6-FLUORO-1H-INDOL-3-YL)PROPANOIC ACID
Definition date:2006-11-20
Last modified:2024-09-27
Identifier:6-fluoro-L-tryptophan
FTR
FTR
Name:FLUOROTRYPTOPHANE
Formula:C11 H11 F N2 O2
SMILES:O=C(O)C(N)Cc2c1cc(F)ccc1nc2
InChi:InChI=1S/C11H11FN2O2/c12-7-1-2-10-8(4-7)6(5-14-10)3-9(13)11(15)16/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m0/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:5-fluoro-L-tryptophan
FTT
FTT
Name:3-HYDROXY-TETRADECANOIC ACID
Formula:C14 H28 O3
SMILES:O=C(O)CC(O)CCCCCCCCCCC
InChi:InChI=1S/C14H28O3/c1-2-3-4-5-6-7-8-9-10-11-13(15)12-14(16)17/h13,15H,2-12H2,1H3,(H,16,17)/t13-/m1/s1
Synonyms:3-HYDROXY-MYRISTIC ACID
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:(3R)-3-hydroxytetradecanoic acid

243083

數據於2025-10-15公開中

PDB statisticsPDBj update infoContact PDBjnumon