Loading
PDBj
English日本語简体中文繁體中文한국어
✖
ﾒﾆｭｰPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDBDonate
RCSB PDBPDBeBMRBAdv. SearchSearch help
ND9
ND9
表記:N-[[1-(4-azanyl-1-phenoxy-cyclohexyl)carbonylpiperidin-4-yl]methyl]-2-chloranyl-ethanamide
組成式:C21 H30 Cl N3 O3
SMILES:N[CH]1CC[C](CC1)(Oc2ccccc2)C(=O)N3CC[CH](CC3)CNC(=O)CCl
InChi:InChI=1S/C21H30ClN3O3/c22-14-19(26)24-15-16-8-12-25(13-9-16)20(27)21(10-6-17(23)7-11-21)28-18-4-2-1-3-5-18/h1-5,16-17H,6-15,23H2,(H,24,26)/t17-,21-
定義日:2022-08-17
最終更新日:2024-09-27
公開日:2023-09-20
識別子（ID）:~{N}-[[1-(4-azanyl-1-phenoxy-cyclohexyl)carbonylpiperidin-4-yl]methyl]-2-chloranyl-ethanamide
NDD
NDD
表記:2,6-DICARBOXYNAPHTHALENE
組成式:C12 H8 O4
SMILES:O=C(O)c1ccc2c(c1)ccc(C(=O)O)c2
InChi:InChI=1S/C12H8O4/c13-11(14)9-3-1-7-5-10(12(15)16)4-2-8(7)6-9/h1-6H,(H,13,14)(H,15,16)
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:naphthalene-2,6-dicarboxylic acid
NDG
NDG
表記:2-acetamido-2-deoxy-alpha-D-glucopyranose
組成式:C8 H15 N O6
SMILES:O=C(NC1C(O)C(O)C(OC1O)CO)C
InChi:InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5-,6-,7-,8+/m1/s1
別名:N-acetyl-alpha-D-glucosamine
定義日:2002-07-02
最終更新日:2024-09-27
識別子（ID）:2-(acetylamino)-2-deoxy-alpha-D-glucopyranose
NDP
NDP
表記:NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE
組成式:C21 H30 N7 O17 P3
SMILES:NC(=O)C1=CN(C=CC1)[CH]2O[CH](CO[P](O)(=O)O[P](O)(=O)OC[CH]3O[CH]([CH](O[P](O)(O)=O)[CH]3O)n4cnc5c(N)ncnc45)[CH](O)[CH]2O
InChi:InChI=1S/C21H30N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1,3-4,7-8,10-11,13-16,20-21,29-31H,2,5-6H2,(H2,23,32)(H,36,37)(H,38,39)(H2,22,24,25)(H2,33,34,35)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:[[(2R,3S,4R,5R)-5-(3-aminocarbonyl-4H-pyridin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl] [(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxy-oxolan-2-yl]methyl hydrogen phosphate
NDU
NDU
表記:2'-DEOXY-5-NITROURIDINE 5'-MONOPHOSPHATE
組成式:C9 H14 N3 O10 P
SMILES:[O-][N+](=O)C1C(=O)NC(=O)N(C1)C2OC(C(O)C2)COP(=O)(O)O
InChi:InChI=1S/C9H14N3O10P/c13-5-1-7(22-6(5)3-21-23(18,19)20)11-2-4(12(16)17)8(14)10-9(11)15/h4-7,13H,1-3H2,(H,10,14,15)(H2,18,19,20)/t4-,5+,6-,7-/m1/s1
定義日:2007-10-27
最終更新日:2024-09-27
識別子（ID）:2'-deoxy-5-nitrouridine 5'-(dihydrogen phosphate)
5CR
5CR
表記:N-acetyl-L-phenylalanine
組成式:C11 H13 N O3
SMILES:CC(=O)N[CH](Cc1ccccc1)C(O)=O
InChi:InChI=1S/C11H13NO3/c1-8(13)12-10(11(14)15)7-9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H,12,13)(H,14,15)/t10-/m0/s1
定義日:2015-10-12
最終更新日:2024-09-27
公開日:2016-11-16
識別子（ID）:(2S)-2-acetamido-3-phenyl-propanoic acid
5CS
5CS
表記:2-AMINO-3-(CYSTEIN-S-YL)-ISOXAZOLIDIN-5-YL-ACETIC ACID
組成式:C8 H15 N3 O5 S
SMILES:O=C(O)C(N)C1ONC(SCC(N)C(=O)O)C1
InChi:InChI=1S/C8H15N3O5S/c9-3(7(12)13)2-17-5-1-4(16-11-5)6(10)8(14)15/h3-6,11H,1-2,9-10H2,(H,12,13)(H,14,15)/t3-,4+,5+,6-/m0/s1
定義日:2003-04-10
最終更新日:2024-09-27
識別子（ID）:S-{(3R,5R)-5-[(S)-amino(carboxy)methyl]isoxazolidin-3-yl}-L-cysteine
5CT
5CT
表記:Hypusine
組成式:C10 H23 N3 O3
SMILES:C(CCNCC(O)CCN)CC(C(=O)O)N
InChi:InChI=1S/C10H23N3O3/c11-5-4-8(14)7-13-6-2-1-3-9(12)10(15)16/h8-9,13-14H,1-7,11-12H2,(H,15,16)/t8-,9-/m0/s1
別名:N~6~-[(2S)-4-amino-2-hydroxybutyl]-L-lysine
定義日:2015-09-07
最終更新日:2024-09-27
公開日:2016-01-20
識別子（ID）:N~6~-[(2S)-4-amino-2-hydroxybutyl]-L-lysine
NE9
NE9
表記:2-chloranyl-N-[7-[4-[(4-chlorophenyl)amino]oxan-4-yl]carbonyl-7-azaspiro[3.5]nonan-2-yl]ethanamide
組成式:C22 H29 Cl2 N3 O3
SMILES:ClCC(=O)NC1CC2(CCN(CC2)C(=O)C3(CCOCC3)Nc4ccc(Cl)cc4)C1
InChi:InChI=1S/C22H29Cl2N3O3/c23-15-19(28)25-18-13-21(14-18)5-9-27(10-6-21)20(29)22(7-11-30-12-8-22)26-17-3-1-16(24)2-4-17/h1-4,18,26H,5-15H2,(H,25,28)
定義日:2022-08-17
最終更新日:2024-09-27
公開日:2023-09-20
識別子（ID）:2-chloranyl-~{N}-[7-[4-[(4-chlorophenyl)amino]oxan-4-yl]carbonyl-7-azaspiro[3.5]nonan-2-yl]ethanamide
5CW
5CW
表記:5-chloro-L-tryptophan
組成式:C11 H11 Cl N2 O2
SMILES:O=C(O)C(N)Cc2c1cc(Cl)ccc1nc2
InChi:InChI=1S/C11H11ClN2O2/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
定義日:2013-12-09
最終更新日:2024-09-27
公開日:2014-03-05
識別子（ID）:5-chloro-L-tryptophan
NEF
NEF
表記:Nitrocefin - open form
組成式:C21 H18 N4 O9 S2
SMILES:OC(=O)[CH](NC(=O)Cc1sccc1)[CH]2NC(=C(CS2)C=Cc3ccc(cc3[N+]([O-])=O)[N+]([O-])=O)C(O)=O
InChi:InChI=1S/C21H18N4O9S2/c26-16(9-14-2-1-7-35-14)22-18(21(29)30)19-23-17(20(27)28)12(10-36-19)4-3-11-5-6-13(24(31)32)8-15(11)25(33)34/h1-8,18-19,23H,9-10H2,(H,22,26)(H,27,28)(H,29,30)/b4-3+/t18-,19+/m0/s1
別名:(2R)-5-[(E)-2-(2,4-dinitrophenyl)ethenyl]-2-[(1R)-2-oxidanyl-2-oxidanylidene-1-(2-thiophen-2-ylethanoylamino)ethyl]-3,6-dihydro-2H-1,3-thiazine-4-carboxylic acid
定義日:2018-09-26
最終更新日:2024-09-27
公開日:2019-10-23
識別子（ID）:(2~{R})-5-[(~{E})-2-(2,4-dinitrophenyl)ethenyl]-2-[(1~{R})-2-oxidanyl-2-oxidanylidene-1-(2-thiophen-2-ylethanoylamino)ethyl]-3,6-dihydro-2~{H}-1,3-thiazine-4-carboxylic acid
NEN
NEN
表記:1-ETHYL-PYRROLIDINE-2,5-DIONE
組成式:C6 H9 N O2
SMILES:O=C1N(C(=O)CC1)CC
InChi:InChI=1S/C6H9NO2/c1-2-7-5(8)3-4-6(7)9/h2-4H2,1H3
定義日:1999-08-17
最終更新日:2024-09-27
識別子（ID）:1-ethylpyrrolidine-2,5-dione
NEP
NEP
表記:N1-PHOSPHONOHISTIDINE
組成式:C6 H10 N3 O5 P
SMILES:O=P(O)(O)n1cc(nc1)CC(C(=O)O)N
InChi:InChI=1S/C6H10N3O5P/c7-5(6(10)11)1-4-2-9(3-8-4)15(12,13)14/h2-3,5H,1,7H2,(H,10,11)(H2,12,13,14)/t5-/m0/s1
定義日:1999-07-26
最終更新日:2024-09-27
識別子（ID）:1-phosphono-L-histidine
5DD
5DD
表記:[(2~{R},3~{S},4~{S})-5-[(4~{a}~{R})-7,8-dimethyl-2,4-bis(oxidanylidene)-4~{a},5-dihydropyrimido[4,5-b]quinolin-10-yl]-2,3,4-tris(oxidanyl)pentyl] dihydrogen phosphate
組成式:C18 H24 N3 O9 P
SMILES:Cc1cc2C[CH]3C(=O)NC(=O)N=C3N(C[CH](O)[CH](O)[CH](O)CO[P](O)(O)=O)c2cc1C
InChi:InChI=1S/C18H24N3O9P/c1-8-3-10-5-11-16(19-18(26)20-17(11)25)21(12(10)4-9(8)2)6-13(22)15(24)14(23)7-30-31(27,28)29/h3-4,11,13-15,22-24H,5-7H2,1-2H3,(H,20,25,26)(H2,27,28,29)/t11-,13+,14-,15+/m1/s1
定義日:2018-10-31
最終更新日:2024-09-27
公開日:2019-05-29
識別子（ID）:[(2~{R},3~{S},4~{S})-5-[(4~{a}~{R})-7,8-dimethyl-2,4-bis(oxidanylidene)-4~{a},5-dihydropyrimido[4,5-b]quinolin-10-yl]-2,3,4-tris(oxidanyl)pentyl] dihydrogen phosphate
NEQ
NEQ
表記:N-ETHYLMALEIMIDE
組成式:C6 H7 N O2
SMILES:O=C1C=CC(=O)N1CC
InChi:InChI=1S/C6H7NO2/c1-2-7-5(8)3-4-6(7)9/h3-4H,2H2,1H3
定義日:2000-11-28
最終更新日:2024-09-27
識別子（ID）:1-ethyl-1H-pyrrole-2,5-dione
5DP
5DP
表記:5-(2,5-dioxopyrrolidin-1-yl)-N-[2-(2-{2-[(4-O-alpha-D-idopyranosyl-alpha-D-mannopyranosyl)oxy]ethoxy}ethoxy)ethyl]pentanamide
組成式:C27 H46 N2 O16
SMILES:O=C1N(C(=O)CC1)CCCCC(=O)NCCOCCOCCOC3OC(C(OC2OC(CO)C(O)C(O)C2O)C(O)C3O)CO
InChi:InChI=1S/C27H46N2O16/c30-13-15-20(35)21(36)23(38)27(43-15)45-25-16(14-31)44-26(24(39)22(25)37)42-12-11-41-10-9-40-8-6-28-17(32)3-1-2-7-29-18(33)4-5-19(29)34/h15-16,20-27,30-31,35-39H,1-14H2,(H,28,32)/t15-,16-,20+,21-,22-,23+,24+,25-,26+,27-/m1/s1
定義日:2008-03-13
最終更新日:2024-09-27
識別子（ID）:5-(2,5-dioxopyrrolidin-1-yl)-N-[2-(2-{2-[(4-O-alpha-D-idopyranosyl-alpha-D-mannopyranosyl)oxy]ethoxy}ethoxy)ethyl]pentanamide
5DW
5DW
表記:4-ethynyl-L-phenylalanine
組成式:C11 H11 N O2
SMILES:C(c1ccc(CC(N)C(=O)O)cc1)#C
InChi:InChI=1S/C11H11NO2/c1-2-8-3-5-9(6-4-8)7-10(12)11(13)14/h1,3-6,10H,7,12H2,(H,13,14)/t10-/m0/s1
定義日:2015-09-14
最終更新日:2024-09-27
公開日:2016-02-03
識別子（ID）:4-ethynyl-L-phenylalanine
NF8
NF8
表記:(2~{R},3~{S},4~{S},5~{S})-5-fluoranyl-2-(hydroxymethyl)oxane-3,4-diol
組成式:C6 H11 F O4
SMILES:OC[CH]1OC[CH](F)[CH](O)[CH]1O
InChi:InChI=1S/C6H11FO4/c7-3-2-11-4(1-8)6(10)5(3)9/h3-6,8-10H,1-2H2/t3-,4+,5+,6+/m0/s1
定義日:2019-11-27
最終更新日:2024-09-27
公開日:2020-06-10
識別子（ID）:(2~{R},3~{S},4~{S},5~{S})-5-fluoranyl-2-(hydroxymethyl)oxane-3,4-diol
NF9
NF9
表記:2-chloranyl-N-[2-[1-[4-[(4-chlorophenyl)amino]oxan-4-yl]carbonylpiperidin-4-yl]ethyl]ethanamide
組成式:C21 H29 Cl2 N3 O3
SMILES:ClCC(=O)NCCC1CCN(CC1)C(=O)C2(CCOCC2)Nc3ccc(Cl)cc3
InChi:InChI=1S/C21H29Cl2N3O3/c22-15-19(27)24-10-5-16-6-11-26(12-7-16)20(28)21(8-13-29-14-9-21)25-18-3-1-17(23)2-4-18/h1-4,16,25H,5-15H2,(H,24,27)
定義日:2022-08-17
最終更新日:2024-09-27
公開日:2023-09-20
識別子（ID）:2-chloranyl-~{N}-[2-[1-[4-[(4-chlorophenyl)amino]oxan-4-yl]carbonylpiperidin-4-yl]ethyl]ethanamide
NFA
NFA
表記:PHENYLALANINE AMIDE
組成式:C9 H12 N2 O
SMILES:O=C(N)C(N)Cc1ccccc1
InChi:InChI=1S/C9H12N2O/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H2,11,12)/t8-/m0/s1
定義日:1999-07-08
最終更新日:2024-09-27
識別子（ID）:L-phenylalaninamide
NFF
NFF
表記:(2R,4S)-2-[(1R)-1-{[(2-ethoxynaphthalen-1-yl)carbonyl]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
組成式:C21 H24 N2 O5 S
SMILES:O=C(NC(C=O)C1SC(C(N1)C(=O)O)(C)C)c3c2ccccc2ccc3OCC
InChi:InChI=1S/C21H24N2O5S/c1-4-28-15-10-9-12-7-5-6-8-13(12)16(15)18(25)22-14(11-24)19-23-17(20(26)27)21(2,3)29-19/h5-11,14,17,19,23H,4H2,1-3H3,(H,22,25)(H,26,27)/t14-,17+,19-/m1/s1
別名:Nafcillin, bound form
定義日:2010-06-28
最終更新日:2024-09-27
識別子（ID）:(2R,4S)-2-[(1R)-1-{[(2-ethoxynaphthalen-1-yl)carbonyl]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
NFK
NFK
表記:N'-Formylkynurenine
組成式:C11 H12 N2 O4
SMILES:O=C(O)C(CC(c1ccccc1NC=O)=O)N
InChi:InChI=1S/C11H12N2O4/c12-8(11(16)17)5-10(15)7-3-1-2-4-9(7)13-6-14/h1-4,6,8H,5,12H2,(H,13,14)(H,16,17)/t8-/m0/s1
別名:(2S)-2-amino-4-[2-(formylamino)phenyl]-4-oxobutanoic acid
定義日:2016-10-04
最終更新日:2024-09-27
公開日:2016-10-26
識別子（ID）:(2S)-2-amino-4-[2-(formylamino)phenyl]-4-oxobutanoic acid
5E8
5E8
表記:ethyl (2Z,4S)-4-{[(2S)-2-methyl-3-phenylpropanoyl]amino}-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate
組成式:C21 H28 N2 O4
SMILES:O=C1C(CCN1)CC(C=C/C(OCC)=O)NC(=O)C(Cc2ccccc2)C
InChi:InChI=1S/C21H28N2O4/c1-3-27-19(24)10-9-18(14-17-11-12-22-21(17)26)23-20(25)15(2)13-16-7-5-4-6-8-16/h4-10,15,17-18H,3,11-14H2,1-2H3,(H,22,26)(H,23,25)/t15-,17-,18+/m0/s1
定義日:2015-09-16
最終更新日:2024-09-27
公開日:2016-03-30
識別子（ID）:ethyl (2Z,4S)-4-{[(2S)-2-methyl-3-phenylpropanoyl]amino}-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate
5E9
5E9
表記:ethyl (2Z,4S)-4-{[(2R,5S)-5-amino-2-(4-fluorobenzyl)-6-methyl-4-oxoheptanoyl]amino}-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate
組成式:C26 H36 F N3 O5
SMILES:C(CC(C(N)C(C)C)=O)(Cc1ccc(cc1)F)C(NC(/C=CC(=O)OCC)CC2CCNC2=O)=O
InChi:InChI=1S/C26H36FN3O5/c1-4-35-23(32)10-9-21(14-18-11-12-29-25(18)33)30-26(34)19(15-22(31)24(28)16(2)3)13-17-5-7-20(27)8-6-17/h5-10,16,18-19,21,24H,4,11-15,28H2,1-3H3,(H,29,33)(H,30,34)/t18-,19+,21+,24-/m0/s1
定義日:2015-09-16
最終更新日:2024-09-27
公開日:2016-03-30
識別子（ID）:ethyl (2Z,4S)-4-{[(2R,5S)-5-amino-2-(4-fluorobenzyl)-6-methyl-4-oxoheptanoyl]amino}-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate
5EB
5EB
表記:ethyl (2Z,4S)-4-{[N-(3-cyclopropylpropanoyl)-L-phenylalanyl]amino}-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate
組成式:C26 H35 N3 O5
SMILES:C(Cc1ccccc1)(C(=O)NC(C=C/C(=O)OCC)CC2C(NCC2)=O)NC(=O)CCC3CC3
InChi:InChI=1S/C26H35N3O5/c1-2-34-24(31)13-11-21(17-20-14-15-27-25(20)32)28-26(33)22(16-19-6-4-3-5-7-19)29-23(30)12-10-18-8-9-18/h3-7,11,13,18,20-22H,2,8-10,12,14-17H2,1H3,(H,27,32)(H,28,33)(H,29,30)/t20-,21+,22-/m0/s1
定義日:2015-09-16
最終更新日:2024-09-27
公開日:2016-03-30
識別子（ID）:ethyl (2Z,4S)-4-{[N-(3-cyclopropylpropanoyl)-L-phenylalanyl]amino}-5-[(3S)-2-oxopyrrolidin-3-yl]pent-2-enoate

233605

件を2025-03-26に公開中

PDB statisticsPDBj update infoContact PDBjnumon