Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help
NKL
NKL
Name:2-chloranyl-1-[2-[4-[(4-chlorophenyl)amino]oxan-4-yl]carbonyl-2,7-diazaspiro[3.5]nonan-7-yl]ethanone
Formula:C21 H27 Cl2 N3 O3
SMILES:ClCC(=O)N1CCC2(CC1)CN(C2)C(=O)C3(CCOCC3)Nc4ccc(Cl)cc4
InChi:InChI=1S/C21H27Cl2N3O3/c22-13-18(27)25-9-5-20(6-10-25)14-26(15-20)19(28)21(7-11-29-12-8-21)24-17-3-1-16(23)2-4-17/h1-4,24H,5-15H2
Definition date:2022-08-17
Last modified:2024-09-27
Release date:2023-09-20
Identifier:2-chloranyl-1-[2-[4-[(4-chlorophenyl)amino]oxan-4-yl]carbonyl-2,7-diazaspiro[3.5]nonan-7-yl]ethanone
7MS
7MS
Name:(5Z,8Z,11Z,14Z,17R,18R)-17,18-dihydroxyicosa-5,8,11,14-tetraenoic acid
Formula:C20 H32 O4
SMILES:CCC(O)C(O)C[C@H]=CC[C@H]=[C@H]C[C@H]=[C@H]C/C=CCCCC(O)=O
InChi:InChI=1S/C20H32O4/c1-2-18(21)19(22)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-20(23)24/h3,5-6,8-9,11-12,14,18-19,21-22H,2,4,7,10,13,15-17H2,1H3,(H,23,24)/b5-3-,8-6-,11-9-,14-12-/t18-,19-/m1/s1
Definition date:2016-11-16
Last modified:2024-09-27
Release date:2017-10-11
Identifier:(5Z,8Z,11Z,14Z,17R,18R)-17,18-dihydroxyicosa-5,8,11,14-tetraenoic acid
7N0
7N0
Name:2-[(1~{S})-2-oxidanylidenecyclopentyl]ethanoic acid
Formula:C7 H10 O3
SMILES:OC(=O)C[CH]1CCCC1=O
InChi:InChI=1S/C7H10O3/c8-6-3-1-2-5(6)4-7(9)10/h5H,1-4H2,(H,9,10)/t5-/m0/s1
Definition date:2016-11-22
Last modified:2024-09-27
Release date:2018-11-07
Identifier:2-[(1~{S})-2-oxidanylidenecyclopentyl]ethanoic acid
7N4
7N4
Name:{3-chloro-4-[(2-fluorophenyl)methoxy]phenyl}borinic acid
Formula:C13 H11 B Cl F O2
SMILES:B(c1cc(c(cc1)OCc2ccccc2F)Cl)O
InChi:InChI=1S/C13H11BClFO2/c15-11-7-10(14-17)5-6-13(11)18-8-9-3-1-2-4-12(9)16/h1-7,14,17H,8H2
Definition date:2016-11-21
Last modified:2024-09-27
Release date:2017-12-06
Identifier:{3-chloro-4-[(2-fluorophenyl)methoxy]phenyl}borinic acid
NL7
NL7
Name:4-[(5-methoxypyridin-3-yl)sulfamoyl]benzene-1-sulfonic acid
Formula:C12 H12 N2 O6 S2
SMILES:c1cc(S(=O)(=O)O)ccc1S(Nc2cc(OC)cnc2)(=O)=O
InChi:InChI=1S/C12H12N2O6S2/c1-20-10-6-9(7-13-8-10)14-21(15,16)11-2-4-12(5-3-11)22(17,18)19/h2-8,14H,1H3,(H,17,18,19)
Definition date:2019-05-20
Last modified:2024-09-27
Release date:2020-03-04
Identifier:4-[(5-methoxypyridin-3-yl)sulfamoyl]benzene-1-sulfonic acid
7N7
7N7
Name:naphthalen-2-ylboronic acid
Formula:C10 H9 B O2
SMILES:c1c2c(cc(B(O)O)c1)cccc2
InChi:InChI=1S/C10H9BO2/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7,12-13H
Definition date:2016-11-21
Last modified:2024-09-27
Release date:2017-12-06
Identifier:naphthalen-2-ylboronic acid
NL9
NL9
Name:[1-(3-chlorophenyl)-1H-pyrazol-4-yl]boronic acid
Formula:C9 H8 B Cl N2 O2
SMILES:Clc1cccc(c1)n2ncc(c2)B(O)O
InChi:InChI=1S/C9H8BClN2O2/c11-8-2-1-3-9(4-8)13-6-7(5-12-13)10(14)15/h1-6,14-15H
Definition date:2013-08-06
Last modified:2024-09-27
Release date:2014-07-30
Identifier:[1-(3-chlorophenyl)-1H-pyrazol-4-yl]boronic acid
7N8
7N8
Name:4-Borono-L-phenylalanine
Formula:C9 H12 B N O4
SMILES:N[CH](Cc1ccc(cc1)B(O)O)C(O)=O
InChi:InChI=1S/C9H12BNO4/c11-8(9(12)13)5-6-1-3-7(4-2-6)10(14)15/h1-4,8,14-15H,5,11H2,(H,12,13)/t8-/m0/s1
Definition date:2016-11-24
Last modified:2024-09-27
Release date:2017-10-11
Identifier:(2~{S})-2-azanyl-3-[4-(dihydroxyboranyl)phenyl]propanoic acid
NLB
NLB
Name:6-(benzyloxy)-L-norleucine
Formula:C13 H19 N O3
SMILES:O=C(O)C(N)CCCCOCc1ccccc1
InChi:InChI=1S/C13H19NO3/c14-12(13(15)16)8-4-5-9-17-10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10,14H2,(H,15,16)/t12-/m0/s1
Definition date:2014-11-09
Last modified:2024-09-27
Release date:2015-02-11
Identifier:6-(benzyloxy)-L-norleucine
NLE
NLE
Name:NORLEUCINE
Formula:C6 H13 N O2
SMILES:O=C(O)C(N)CCCC
InChi:InChI=1S/C6H13NO2/c1-2-3-4-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-/m0/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:L-norleucine
7ND
7ND
Name:(3-bromo-5-phenoxyphenyl)boronic acid
Formula:C12 H10 B Br O3
SMILES:Brc1cc(cc(c1)B(O)O)Oc2ccccc2
InChi:InChI=1S/C12H10BBrO3/c14-10-6-9(13(15)16)7-12(8-10)17-11-4-2-1-3-5-11/h1-8,15-16H
Definition date:2016-11-21
Last modified:2024-09-27
Release date:2017-12-06
Identifier:(3-bromo-5-phenoxyphenyl)boronic acid
NLF
NLF
Name:N-formyl-L-tryptophan
Formula:C12 H12 N2 O3
SMILES:O=C(O)C(NC=O)Cc1c[NH]c2ccccc21
InChi:InChI=1S/C12H12N2O3/c15-7-14-11(12(16)17)5-8-6-13-10-4-2-1-3-9(8)10/h1-4,6-7,11,13H,5H2,(H,14,15)(H,16,17)/t11-/m0/s1
Definition date:2022-04-05
Last modified:2024-09-27
Release date:2022-08-17
Identifier:N-formyl-L-tryptophan
NLG
NLG
Name:N-ACETYL-L-GLUTAMATE
Formula:C7 H11 N O5
SMILES:O=C(NC(C(=O)O)CCC(=O)O)C
InChi:InChI=1S/C7H11NO5/c1-4(9)8-5(7(12)13)2-3-6(10)11/h5H,2-3H2,1H3,(H,8,9)(H,10,11)(H,12,13)/t5-/m0/s1
Definition date:2001-12-28
Last modified:2024-09-27
Identifier:N-acetyl-L-glutamic acid
7NF
7NF
Name:2-ethoxycarbonyl-1,3-thiazole-4-carboxylic acid
Formula:C7 H7 N O4 S
SMILES:CCOC(=O)c1scc(n1)C(O)=O
InChi:InChI=1S/C7H7NO4S/c1-2-12-7(11)5-8-4(3-13-5)6(9)10/h3H,2H2,1H3,(H,9,10)
Definition date:2016-11-27
Last modified:2024-09-27
Release date:2017-12-20
Identifier:2-ethoxycarbonyl-1,3-thiazole-4-carboxylic acid
NLJ
NLJ
Name:4-[(2-methoxypyridin-3-yl)sulfamoyl]benzene-1-sulfonic acid
Formula:C12 H12 N2 O6 S2
SMILES:c1(ccc(cc1)S(=O)(=O)O)S(Nc2c(nccc2)OC)(=O)=O
InChi:InChI=1S/C12H12N2O6S2/c1-20-12-11(3-2-8-13-12)14-21(15,16)9-4-6-10(7-5-9)22(17,18)19/h2-8,14H,1H3,(H,17,18,19)
Definition date:2019-05-20
Last modified:2024-09-27
Release date:2020-03-04
Identifier:4-[(2-methoxypyridin-3-yl)sulfamoyl]benzene-1-sulfonic acid
7NJ
7NJ
Name:(3-bromo-4-methylphenyl)boronic acid
Formula:C7 H8 B Br O2
SMILES:Brc1c(ccc(c1)B(O)O)C
InChi:InChI=1S/C7H8BBrO2/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4,10-11H,1H3
Definition date:2016-11-21
Last modified:2024-09-27
Release date:2017-12-06
Identifier:(3-bromo-4-methylphenyl)boronic acid
NLM
NLM
Name:4-[(3-chloropyridin-2-yl)sulfamoyl]benzene-1-sulfonic acid
Formula:C11 H9 Cl N2 O5 S2
SMILES:N(S(c1ccc(cc1)S(=O)(=O)O)(=O)=O)c2ncccc2Cl
InChi:InChI=1S/C11H9ClN2O5S2/c12-10-2-1-7-13-11(10)14-20(15,16)8-3-5-9(6-4-8)21(17,18)19/h1-7H,(H,13,14)(H,17,18,19)
Definition date:2019-05-20
Last modified:2024-09-27
Release date:2020-03-04
Identifier:4-[(3-chloropyridin-2-yl)sulfamoyl]benzene-1-sulfonic acid
7NM
7NM
Name:[3-(benzyloxy)-4-methylphenyl]borinic acid
Formula:C14 H15 B O2
SMILES:Cc2c(OCc1ccccc1)cc(cc2)BO
InChi:InChI=1S/C14H15BO2/c1-11-7-8-13(15-16)9-14(11)17-10-12-5-3-2-4-6-12/h2-9,15-16H,10H2,1H3
Definition date:2016-11-21
Last modified:2024-09-27
Release date:2017-12-06
Identifier:[3-(benzyloxy)-4-methylphenyl]borinic acid
NLN
NLN
Name:NORLEUCINE AMIDE
Formula:C6 H14 N2 O
SMILES:O=C(N)C(N)CCCC
InChi:InChI=1S/C6H14N2O/c1-2-3-4-5(7)6(8)9/h5H,2-4,7H2,1H3,(H2,8,9)/t5-/m0/s1
Synonyms:2-AMINO-HEXANOIC ACID AMIDE
Definition date:2000-02-02
Last modified:2024-09-27
Identifier:L-norleucinamide
NLO
NLO
Name:O-METHYL-L-NORLEUCINE
Formula:C7 H15 N O2
SMILES:O=C(OC)C(N)CCCC
InChi:InChI=1S/C7H15NO2/c1-3-4-5-6(8)7(9)10-2/h6H,3-5,8H2,1-2H3/t6-/m0/s1
Definition date:2004-01-27
Last modified:2024-09-27
Identifier:methyl L-norleucinate
7NP
7NP
Name:(2S)-7-methoxy-2-methyl-3,4-dihydronaphthalen-1(2H)-one
Formula:C12 H14 O2
SMILES:O=C2c1c(ccc(OC)c1)CCC2C
InChi:InChI=1S/C12H14O2/c1-8-3-4-9-5-6-10(14-2)7-11(9)12(8)13/h5-8H,3-4H2,1-2H3/t8-/m0/s1
Synonyms:Bound form of 7-METHOXY-2-(PIPERIDIN-1-YLMETHYL)-3,4-DIHYDRONAPHTHALEN-1(2H)-ONE HYDROCHLORDIDE
Definition date:2014-06-09
Last modified:2024-09-27
Release date:2014-07-23
Identifier:(2S)-7-methoxy-2-methyl-3,4-dihydronaphthalen-1(2H)-one
7NQ
7NQ
Name:~{N}-(4-ethoxyquinazolin-2-yl)propanamide
Formula:C13 H15 N3 O2
SMILES:CCOc1nc(NC(=O)CC)nc2ccccc12
InChi:InChI=1S/C13H15N3O2/c1-3-11(17)15-13-14-10-8-6-5-7-9(10)12(16-13)18-4-2/h5-8H,3-4H2,1-2H3,(H,14,15,16,17)
Definition date:2016-11-28
Last modified:2024-09-27
Release date:2017-11-01
Identifier:~{N}-(4-ethoxyquinazolin-2-yl)propanamide
NLS
NLS
Name:4-[(6-fluoropyridin-2-yl)sulfamoyl]benzene-1-sulfonic acid
Formula:C11 H9 F N2 O5 S2
SMILES:N(c1nc(F)ccc1)S(c2ccc(S(=O)(=O)O)cc2)(=O)=O
InChi:InChI=1S/C11H9FN2O5S2/c12-10-2-1-3-11(13-10)14-20(15,16)8-4-6-9(7-5-8)21(17,18)19/h1-7H,(H,13,14)(H,17,18,19)
Definition date:2019-05-20
Last modified:2024-09-27
Release date:2020-03-04
Identifier:4-[(6-fluoropyridin-2-yl)sulfamoyl]benzene-1-sulfonic acid
7NS
7NS
Name:[3-bromo-5-(pyrrolidin-1-yl)phenyl]borinic acid
Formula:C10 H13 B Br N O
SMILES:Brc1cc(BO)cc(c1)N2CCCC2
InChi:InChI=1S/C10H13BBrNO/c12-9-5-8(11-14)6-10(7-9)13-3-1-2-4-13/h5-7,11,14H,1-4H2
Definition date:2016-11-21
Last modified:2024-09-27
Release date:2017-12-06
Identifier:[3-bromo-5-(pyrrolidin-1-yl)phenyl]borinic acid
NLV
NLV
Name:4-[(6-chloropyridin-2-yl)sulfamoyl]benzene-1-sulfonic acid
Formula:C11 H9 Cl N2 O5 S2
SMILES:N(c1nc(Cl)ccc1)S(c2ccc(cc2)S(=O)(=O)O)(=O)=O
InChi:InChI=1S/C11H9ClN2O5S2/c12-10-2-1-3-11(13-10)14-20(15,16)8-4-6-9(7-5-8)21(17,18)19/h1-7H,(H,13,14)(H,17,18,19)
Definition date:2019-05-20
Last modified:2024-09-27
Release date:2020-03-04
Identifier:4-[(6-chloropyridin-2-yl)sulfamoyl]benzene-1-sulfonic acid

225946

數據於2024-10-09公開中

PDB statisticsPDBj update infoContact PDBjnumon