Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help
GZB
GZB
Name:2-benzamidoethanoic acid
Formula:C9 H9 N O3
SMILES:OC(=O)CNC(=O)c1ccccc1
InChi:InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12)
Definition date:2017-07-22
Last modified:2024-09-27
Release date:2017-11-29
Identifier:2-benzamidoethanoic acid
GZJ
GZJ
Name:(2S)-2-(acetylamino)butanoic acid
Formula:C6 H11 N O3
SMILES:CC(NC(C(=O)O)CC)=O
InChi:InChI=1S/C6H11NO3/c1-3-5(6(9)10)7-4(2)8/h5H,3H2,1-2H3,(H,7,8)(H,9,10)/t5-/m0/s1
Definition date:2018-06-06
Last modified:2024-09-27
Release date:2019-04-17
Identifier:(2S)-2-(acetylamino)butanoic acid
GZS
GZS
Name:4-[(4-phenoxyphenyl)sulfonylamino]butanoic acid
Formula:C16 H17 N O5 S
SMILES:OC(=O)CCCN[S](=O)(=O)c1ccc(Oc2ccccc2)cc1
InChi:InChI=1S/C16H17NO5S/c18-16(19)7-4-12-17-23(20,21)15-10-8-14(9-11-15)22-13-5-2-1-3-6-13/h1-3,5-6,8-11,17H,4,7,12H2,(H,18,19)
Definition date:2022-05-18
Last modified:2024-09-27
Release date:2022-06-29
Identifier:4-[(4-phenoxyphenyl)sulfonylamino]butanoic acid
GZY
GZY
Name:1-[(2S)-2-(3-methoxyphenyl)pyrrolidin-1-yl]ethan-1-one
Formula:C13 H17 N O2
SMILES:C1C(N(C(=O)C)CC1)c2cccc(c2)OC
InChi:InChI=1S/C13H17NO2/c1-10(15)14-8-4-7-13(14)11-5-3-6-12(9-11)16-2/h3,5-6,9,13H,4,7-8H2,1-2H3/t13-/m0/s1
Definition date:2018-06-08
Last modified:2024-09-27
Release date:2019-03-27
Identifier:1-[(2S)-2-(3-methoxyphenyl)pyrrolidin-1-yl]ethan-1-one
H00
H00
Name:4-sulfanylbutanoic acid
Formula:C4 H8 O2 S
SMILES:C(C(=O)O)CCS
InChi:InChI=1S/C4H8O2S/c5-4(6)2-1-3-7/h7H,1-3H2,(H,5,6)
Definition date:2017-08-15
Last modified:2024-09-27
Release date:2018-02-21
Identifier:4-sulfanylbutanoic acid
H0A
H0A
Name:1-[(2S)-2-(4-methoxyphenyl)-2,3,6,7-tetrahydro-1H-azepin-1-yl]ethan-1-one
Formula:C15 H19 N O2
SMILES:c1(ccc(cc1)OC)C2N(CCC=CC2)C(=O)C
InChi:InChI=1S/C15H19NO2/c1-12(17)16-11-5-3-4-6-15(16)13-7-9-14(18-2)10-8-13/h3-4,7-10,15H,5-6,11H2,1-2H3/t15-/m0/s1
Definition date:2018-06-08
Last modified:2024-09-27
Release date:2019-03-27
Identifier:1-[(2S)-2-(4-methoxyphenyl)-2,3,6,7-tetrahydro-1H-azepin-1-yl]ethan-1-one
H0E
H0E
Name:(10S)-3,3-dimethyl-8-{[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl}-2,3,4,10-tetrahydropyrimido[1,2-a]indol-10-ol
Formula:C24 H29 N3 O4 S
SMILES:O=S(=O)(c3ccc2N1C(=NCC(C)(C)C1)C(O)c2c3)N5C(COc4ccccc4)CCC5
InChi:InChI=1S/C24H29N3O4S/c1-24(2)15-25-23-22(28)20-13-19(10-11-21(20)26(23)16-24)32(29,30)27-12-6-7-17(27)14-31-18-8-4-3-5-9-18/h3-5,8-11,13,17,22,28H,6-7,12,14-16H2,1-2H3/t17-,22-/m0/s1
Definition date:2009-04-10
Last modified:2024-09-27
Identifier:(10S)-3,3-dimethyl-8-{[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl}-2,3,4,10-tetrahydropyrimido[1,2-a]indol-10-ol
H0F
H0F
Name:2-[(2~{S})-1-[(2~{S},3~{S})-3-methyl-2-(methylamino)pentanoyl]pyrrolidin-2-yl]ethanamide
Formula:C13 H25 N3 O2
SMILES:CC[CH](C)[CH](NC)C(=O)N1CCC[CH]1CC(N)=O
InChi:InChI=1S/C13H25N3O2/c1-4-9(2)12(15-3)13(18)16-7-5-6-10(16)8-11(14)17/h9-10,12,15H,4-8H2,1-3H3,(H2,14,17)/t9-,10-,12-/m0/s1
Definition date:2022-05-18
Last modified:2024-09-27
Release date:2022-06-29
Identifier:2-[(2~{S})-1-[(2~{S},3~{S})-3-methyl-2-(methylamino)pentanoyl]pyrrolidin-2-yl]ethanamide
H0O
H0O
Name:~{N}-[4-[3,5-dimethyl-4-(5-methyl-2~{H}-indazol-4-yl)pyrazol-1-yl]phenyl]propanamide
Formula:C22 H23 N5 O
SMILES:CCC(=O)Nc1ccc(cc1)n2nc(C)c(c2C)c3c(C)ccc4n[nH]cc34
InChi:InChI=1S/C22H23N5O/c1-5-20(28)24-16-7-9-17(10-8-16)27-15(4)22(14(3)26-27)21-13(2)6-11-19-18(21)12-23-25-19/h6-12H,5H2,1-4H3,(H,23,25)(H,24,28)
Definition date:2022-02-07
Last modified:2024-09-27
Release date:2022-04-27
Identifier:~{N}-[4-[3,5-dimethyl-4-(5-methyl-2~{H}-indazol-4-yl)pyrazol-1-yl]phenyl]propanamide
H14
H14
Name:(2S,3R)-BETA-HYDROXY-PHENYLALANINE
Formula:C9 H11 N O3
SMILES:O=C(O)C(N)C(O)c1ccccc1
InChi:InChI=1S/C9H11NO3/c10-7(9(12)13)8(11)6-4-2-1-3-5-6/h1-5,7-8,11H,10H2,(H,12,13)/t7-,8+/m0/s1
Synonyms:BETA-HYDROXY-PHENYLALANINE
Definition date:2008-10-17
Last modified:2024-09-27
Release date:2012-12-21
Identifier:(betaR)-beta-hydroxy-L-phenylalanine
H2A
H2A
Name:(6R,7R)-3-[(ACETYLOXY)METHYL]-7-{[(6S)-6-(GLYCYLAMINO)-7-OXIDO-7-OXOHEPTANOYL]AMINO}-8-OXO-5-THIA-1-AZABICYCLO[4.2.0]OCTANE-2-CARBOXYLATE
Formula:C19 H27 N4 O9 S
SMILES:[O-]C(=O)C(NC(=O)C[NH3+])CCCCC(=O)NC2C(=O)N1C2SCC(COC(=O)C)C1C([O-])=O
InChi:InChI=1S/C19H28N4O9S/c1-9(24)32-7-10-8-33-17-14(16(27)23(17)15(10)19(30)31)22-12(25)5-3-2-4-11(18(28)29)21-13(26)6-20/h10-11,14-15,17H,2-8,20H2,1H3,(H,21,26)(H,22,25)(H,28,29)(H,30,31)/p-1/t10-,11+,14-,15+,17-/m1/s1
Definition date:2003-07-18
Last modified:2024-09-27
Identifier:(2S,3R,6R,7R)-3-[(acetyloxy)methyl]-7-({(6S)-6-[(ammonioacetyl)amino]-6-carboxylatohexanoyl}amino)-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate
H2S
H2S
Name:HYDROSULFURIC ACID
Formula:H2 S
SMILES:S
InChi:InChI=1S/H2S/h1H2
Synonyms:HYDROGEN SULFIDE
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:sulfane
H2T
H2T
Name:1-[6-[4-(5-chloranyl-6-methyl-1~{H}-indazol-4-yl)-5-methyl-3-(1-methylindazol-5-yl)pyrazol-1-yl]-2-azaspiro[3.3]heptan-2-yl]propan-1-one
Formula:C29 H30 Cl N7 O
SMILES:CCC(=O)N1CC2(CC(C2)n3nc(c4ccc5n(C)ncc5c4)c(c3C)c6c(Cl)c(C)cc7[nH]ncc67)C1
InChi:InChI=1S/C29H30ClN7O/c1-5-24(38)36-14-29(15-36)10-20(11-29)37-17(3)25(26-21-13-31-33-22(21)8-16(2)27(26)30)28(34-37)18-6-7-23-19(9-18)12-32-35(23)4/h6-9,12-13,20H,5,10-11,14-15H2,1-4H3,(H,31,33)
Definition date:2022-02-07
Last modified:2024-09-27
Release date:2022-04-27
Identifier:1-[6-[4-(5-chloranyl-6-methyl-1~{H}-indazol-4-yl)-5-methyl-3-(1-methylindazol-5-yl)pyrazol-1-yl]-2-azaspiro[3.3]heptan-2-yl]propan-1-one
H2U
H2U
Name:5,6-DIHYDROURIDINE-5'-MONOPHOSPHATE
Formula:C9 H15 N2 O9 P
SMILES:O=C1N(CCC(=O)N1)C2OC(C(O)C2O)COP(=O)(O)O
InChi:InChI=1S/C9H15N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h4,6-8,13-14H,1-3H2,(H,10,12,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
Definition date:1999-07-08
Last modified:2024-09-27
Identifier:5'-uridylic acid
H2V
H2V
Name:S-[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] aminoethanethioate
Formula:C13 H26 N3 O8 P S
SMILES:O=C(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)O)CN
InChi:InChI=1S/C13H26N3O8PS/c1-13(2,8-24-25(21,22)23)11(19)12(20)16-4-3-9(17)15-5-6-26-10(18)7-14/h11,19H,3-8,14H2,1-2H3,(H,15,17)(H,16,20)(H2,21,22,23)/t11-/m1/s1
Synonyms:S-glycyl-4'-phosphopantetheine
Definition date:2012-09-21
Last modified:2024-09-27
Release date:2013-03-06
Identifier:S-[2-({N-[(2S)-2-hydroxy-3,3-dimethyl-4-(phosphonooxy)butanoyl]-beta-alanyl}amino)ethyl] aminoethanethioate
H37
H37
Name:D-phenylalanyl-N-[(3S)-6-carbamimidamido-1-chloro-2-oxohexan-3-yl]-L-phenylalaninamide
Formula:C25 H33 Cl N6 O3
SMILES:ClCC(=O)C(NC(=O)C(NC(=O)C(N)Cc1ccccc1)Cc2ccccc2)CCCNC(=[N@H])N
InChi:InChI=1S/C25H33ClN6O3/c26-16-22(33)20(12-7-13-30-25(28)29)31-24(35)21(15-18-10-5-2-6-11-18)32-23(34)19(27)14-17-8-3-1-4-9-17/h1-6,8-11,19-21H,7,12-16,27H2,(H,31,35)(H,32,34)(H4,28,29,30)/t19-,20+,21+/m1/s1
Synonyms:FFRCK
Definition date:2010-11-09
Last modified:2024-09-27
Identifier:D-phenylalanyl-N-[(3S)-6-carbamimidamido-1-chloro-2-oxohexan-3-yl]-L-phenylalaninamide
H3D
H3D
Name:N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]acetamide
Formula:C15 H19 N O3
SMILES:C3C(c1cc2c(cc1)OCCO2)(NC(=O)C)CCC3
InChi:InChI=1S/C15H19NO3/c1-11(17)16-15(6-2-3-7-15)12-4-5-13-14(10-12)19-9-8-18-13/h4-5,10H,2-3,6-9H2,1H3,(H,16,17)
Definition date:2018-06-11
Last modified:2024-09-27
Release date:2019-03-27
Identifier:N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]acetamide
H40
H40
Name:~{N}-[4-[2-bromanyl-6-(2-hydroxyethylamino)pyridin-4-yl]sulfanylphenyl]propanamide
Formula:C16 H18 Br N3 O2 S
SMILES:Brc1cc(Sc2ccc(NC(=O)CC)cc2)cc(NCCO)n1
InChi:InChI=1S/C16H18BrN3O2S/c1-2-16(22)19-11-3-5-12(6-4-11)23-13-9-14(17)20-15(10-13)18-7-8-21/h3-6,9-10,21H,2,7-8H2,1H3,(H,18,20)(H,19,22)
Definition date:2022-02-07
Last modified:2024-09-27
Release date:2022-04-27
Identifier:N-[4-({2-bromo-6-[(2-hydroxyethyl)amino]pyridin-4-yl}sulfanyl)phenyl]propanamide
2Z0
2Z0
Name:N-{[5-(dimethylamino)naphthalen-2-yl]sulfonyl}-L-alpha-glutamyl-N-[(1S)-4-{[amino(iminio)methyl]amino}-1-(chloroacetyl) butyl]glycinamide
Formula:C26 H37 Cl N7 O7 S
SMILES:ClCC(=O)C(NC(=O)CNC(=O)C(NS(=O)(=O)c2ccc1c(cccc1N(C)C)c2)CCC(=O)O)CCCNC(=[NH2+])N
InChi:InChI=1S/C26H36ClN7O7S/c1-34(2)21-7-3-5-16-13-17(8-9-18(16)21)42(40,41)33-20(10-11-24(37)38)25(39)31-15-23(36)32-19(22(35)14-27)6-4-12-30-26(28)29/h3,5,7-9,13,19-20,33H,4,6,10-12,14-15H2,1-2H3,(H,31,39)(H,32,36)(H,37,38)(H4,28,29,30)/p+1/t19-,20-/m0/s1
Synonyms:dansyl-Glu-Gly-Arg-chloromethyl-ketone
Definition date:2008-08-28
Last modified:2024-09-27
Identifier:N-{[5-(dimethylamino)naphthalen-2-yl]sulfonyl}-L-alpha-glutamyl-N-[(3S)-6-{[amino(iminio)methyl]amino}-1-chloro-2-oxohexan-3-yl]glycinamide
2ZC
2ZC
Name:O-{[4-(2-aminoethyl)phenyl]sulfonyl}-L-serine
Formula:C11 H16 N2 O5 S
SMILES:O=C(O)C(N)COS(=O)(=O)c1ccc(cc1)CCN
InChi:InChI=1S/C11H16N2O5S/c12-6-5-8-1-3-9(4-2-8)19(16,17)18-7-10(13)11(14)15/h1-4,10H,5-7,12-13H2,(H,14,15)/t10-/m0/s1
Definition date:2014-05-01
Last modified:2024-09-27
Release date:2014-05-14
Identifier:O-{[4-(2-aminoethyl)phenyl]sulfonyl}-L-serine
2ZF
2ZF
Name:N-(tert-butoxycarbonyl)-L-alpha-glutamyl-N-[(1R)-1-(carboxycarbonyl)-3,3-difluoropropyl]-L-leucinamide
Formula:C21 H33 F2 N3 O9
SMILES:O=C(OC(C)(C)C)NC(C(=O)NC(C(=O)NC(C(=O)C(=O)O)CC(F)F)CC(C)C)CCC(=O)O
InChi:InChI=1S/C21H33F2N3O9/c1-10(2)8-13(18(31)24-12(9-14(22)23)16(29)19(32)33)25-17(30)11(6-7-15(27)28)26-20(34)35-21(3,4)5/h10-14H,6-9H2,1-5H3,(H,24,31)(H,25,30)(H,26,34)(H,27,28)(H,32,33)/t11-,12-,13-/m0/s1
Definition date:2008-12-12
Last modified:2024-09-27
Identifier:N-(tert-butoxycarbonyl)-L-alpha-glutamyl-N-[(1R)-1-(carboxycarbonyl)-3,3-difluoropropyl]-L-leucinamide
300
300
Name:2-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATE
Formula:C8 H9 O6 P
SMILES:O=Cc1cccc(OC)c1OP(=O)(O)O
InChi:InChI=1S/C8H9O6P/c1-13-7-4-2-3-6(5-9)8(7)14-15(10,11)12/h2-5H,1H3,(H2,10,11,12)
Synonyms:RU78300
Definition date:2003-06-20
Last modified:2024-09-27
Identifier:2-formyl-6-methoxyphenyl dihydrogen phosphate
30F
30F
Name:(2Z)-2-amino-3-selanylprop-2-enoic acid
Formula:C3 H5 N O2 Se
SMILES:O=C(O)/C(N)=C/[SeH]
InChi:InChI=1S/C3H5NO2Se/c4-2(1-7)3(5)6/h1,7H,4H2,(H,5,6)/b2-1-
Definition date:2014-05-06
Last modified:2024-09-27
Release date:2015-03-04
Identifier:(2Z)-2-amino-3-selanylprop-2-enoic acid
H5D
H5D
Name:2-{3-[(2S)-1-acetylpyrrolidin-2-yl]phenyl}-N-(3-chlorophenyl)acetamide
Formula:C20 H21 Cl N2 O2
SMILES:N(c1cccc(c1)Cl)C(Cc3cc(C2CCCN2C(=O)C)ccc3)=O
InChi:InChI=1S/C20H21ClN2O2/c1-14(24)23-10-4-9-19(23)16-6-2-5-15(11-16)12-20(25)22-18-8-3-7-17(21)13-18/h2-3,5-8,11,13,19H,4,9-10,12H2,1H3,(H,22,25)/t19-/m0/s1
Definition date:2018-06-11
Last modified:2024-09-27
Release date:2019-03-27
Identifier:2-{3-[(2S)-1-acetylpyrrolidin-2-yl]phenyl}-N-(3-chlorophenyl)acetamide
30S
30S
Name:2-{[(2,4-diaminoquinazolin-5-yl)oxy]methyl}benzenesulfonic acid
Formula:C15 H14 N4 O4 S
SMILES:O=S(=O)(O)c1ccccc1COc3c2c(nc(nc2N)N)ccc3
InChi:InChI=1S/C15H14N4O4S/c16-14-13-10(18-15(17)19-14)5-3-6-11(13)23-8-9-4-1-2-7-12(9)24(20,21)22/h1-7H,8H2,(H,20,21,22)(H4,16,17,18,19)
Definition date:2014-05-14
Last modified:2024-09-27
Release date:2015-05-13
Identifier:2-{[(2,4-diaminoquinazolin-5-yl)oxy]methyl}benzenesulfonic acid

226262

數據於2024-10-16公開中

PDB statisticsPDBj update infoContact PDBjnumon