Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help
TCQ
TCQ
Name:(1S,2R)-N-{(1E)-5-[(2S)-2-amino-2-carboxyethyl]-2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene}-2-phenylcyclopropanaminium
Formula:C18 H19 N2 O4
SMILES:O=C(O)C(N)CC=3C(=O)C=C(O)C(=[NH+]C2CC2c1ccccc1)C=3
InChi:InChI=1S/C18H18N2O4/c19-13(18(23)24)6-11-7-15(17(22)9-16(11)21)20-14-8-12(14)10-4-2-1-3-5-10/h1-5,7,9,12-14,22H,6,8,19H2,(H,23,24)/p+1/b20-15+/t12-,13+,14+/m1/s1
Definition date:2004-07-27
Last modified:2023-11-03
Identifier:(1S,2R)-N-{(1E)-5-[(2S)-2-amino-2-carboxyethyl]-2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene}-2-phenylcyclopropanaminium
TDF
TDF
Name:4-(trifluoromethyl)-D-phenylalanine
Formula:C10 H10 F3 N O2
SMILES:FC(F)(F)c1ccc(cc1)CC(C(=O)O)N
InChi:InChI=1S/C10H10F3NO2/c11-10(12,13)7-3-1-6(2-4-7)5-8(14)9(15)16/h1-4,8H,5,14H2,(H,15,16)/t8-/m1/s1
Definition date:2011-09-15
Last modified:2023-11-03
Identifier:4-(trifluoromethyl)-D-phenylalanine
TEE
TEE
Name:2-AMINO-ETHENETHIOL
Formula:C2 H5 N S
SMILES:S/C=CN
InChi:InChI=1S/C2H5NS/c3-1-2-4/h1-2,4H,3H2/b2-1-
Synonyms:2-THIOETHENAMINE
Definition date:2002-10-04
Last modified:2023-11-03
Identifier:(Z)-2-aminoethenethiol
TFW
TFW
Name:5,6,7-trifluoro-tryptophan
Formula:C11 H9 F3 N2 O2
SMILES:N[CH](Cc1c[nH]c2c(F)c(F)c(F)cc12)C(O)=O
InChi:InChI=1S/C11H9F3N2O2/c12-6-2-5-4(1-7(15)11(17)18)3-16-10(5)9(14)8(6)13/h2-3,7,16H,1,15H2,(H,17,18)/t7-/m0/s1
Synonyms:(2S)-2-azanyl-3-[5,6,7-tris(fluoranyl)-1H-indol-3-yl]propanoic acid
Definition date:2022-02-10
Last modified:2023-11-03
Release date:2022-11-23
Identifier:(2~{S})-2-azanyl-3-[5,6,7-tris(fluoranyl)-1~{H}-indol-3-yl]propanoic acid
TIG
TIG
Name:N-(2-aminoethyl)-L-tryptophan
Formula:C13 H17 N3 O2
SMILES:O=C(O)C(NCCN)Cc2c1ccccc1nc2
InChi:InChI=1S/C13H17N3O2/c14-5-6-15-12(13(17)18)7-9-8-16-11-4-2-1-3-10(9)11/h1-4,8,12,15-16H,5-7,14H2,(H,17,18)/t12-/m0/s1
Definition date:2010-10-14
Last modified:2023-11-03
Identifier:N-(2-aminoethyl)-L-tryptophan
TIH
TIH
Name:BETA(2-THIENYL)ALANINE
Formula:C7 H9 N O2 S
SMILES:O=C(O)C(N)Cc1sccc1
InChi:InChI=1S/C7H9NO2S/c8-6(7(9)10)4-5-2-1-3-11-5/h1-3,6H,4,8H2,(H,9,10)/t6-/m0/s1
Definition date:1999-07-08
Last modified:2023-11-03
Identifier:3-thiophen-2-yl-L-alanine
WCR
WCR
Name:[(2R,4Z)-2-(aminomethyl)-2-hydroxy-4-(4-hydroxybenzylidene)-5-oxoimidazolidin-1-yl]acetic acid
Formula:C13 H15 N3 O5
SMILES:O=C(O)CN1C(=O)/C(NC1(O)CN)=C/c2ccc(O)cc2
InChi:InChI=1S/C13H15N3O5/c14-7-13(21)15-10(12(20)16(13)6-11(18)19)5-8-1-3-9(17)4-2-8/h1-5,15,17,21H,6-7,14H2,(H,18,19)/b10-5-/t13-/m1/s1
Definition date:2011-07-18
Last modified:2023-11-03
Identifier:[(2R,4Z)-2-(aminomethyl)-2-hydroxy-4-(4-hydroxybenzylidene)-5-oxoimidazolidin-1-yl]acetic acid
WFP
WFP
Name:3,5-difluoro-L-phenylalanine
Formula:C9 H9 F2 N O2
SMILES:N[CH](Cc1cc(F)cc(F)c1)C(O)=O
InChi:InChI=1S/C9H9F2NO2/c10-6-1-5(2-7(11)4-6)3-8(12)9(13)14/h1-2,4,8H,3,12H2,(H,13,14)/t8-/m0/s1
Definition date:2009-12-13
Last modified:2023-11-03
Identifier:(2S)-2-azanyl-3-(3,5-difluorophenyl)propanoic acid
WG0
WG0
Name:[(6S,10P)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl]acetic acid
Formula:C19 H17 Cl N4 O2 S
SMILES:O=C(O)CC1N=C(c2ccc(Cl)cc2)c2c(C)c(C)sc2n2c(C)nnc21
InChi:InChI=1S/C19H17ClN4O2S/c1-9-10(2)27-19-16(9)17(12-4-6-13(20)7-5-12)21-14(8-15(25)26)18-23-22-11(3)24(18)19/h4-7,14H,8H2,1-3H3,(H,25,26)/t14-/m0/s1
Definition date:2022-09-07
Last modified:2023-11-03
Release date:2023-10-04
Identifier:[(6S,10P)-4-(4-chlorophenyl)-2,3,9-trimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-6-yl]acetic acid
UQ4
UQ4
Name:N-(7-nitro-2,1,3-benzoxadiazol-4-yl)-beta-alanine
Formula:C9 H8 N4 O5
SMILES:C(=O)(CCNc1c2c(c(cc1)N(=O)=O)non2)O
InChi:InChI=1S/C9H8N4O5/c14-7(15)3-4-10-5-1-2-6(13(16)17)9-8(5)11-18-12-9/h1-2,10H,3-4H2,(H,14,15)
Definition date:2020-05-27
Last modified:2023-11-03
Release date:2020-06-03
Identifier:N-(7-nitro-2,1,3-benzoxadiazol-4-yl)-beta-alanine
URL
URL
Name:[(2~{S})-2-azanyl-4-methyl-pentyl]carbamic acid
Formula:C7 H16 N2 O2
SMILES:CC(C)C[CH](N)CNC(O)=O
InChi:InChI=1S/C7H16N2O2/c1-5(2)3-6(8)4-9-7(10)11/h5-6,9H,3-4,8H2,1-2H3,(H,10,11)/t6-/m0/s1
Definition date:2018-08-22
Last modified:2023-11-03
Release date:2021-02-17
Identifier:[(2~{S})-2-azanyl-4-methyl-pentyl]carbamic acid
URV
URV
Name:[(2~{S})-2-azanyl-3-methyl-butyl]carbamic acid
Formula:C6 H14 N2 O2
SMILES:CC(C)[CH](N)CNC(O)=O
InChi:InChI=1S/C6H14N2O2/c1-4(2)5(7)3-8-6(9)10/h4-5,8H,3,7H2,1-2H3,(H,9,10)/t5-/m1/s1
Definition date:2019-10-12
Last modified:2023-11-03
Release date:2021-02-17
Identifier:[(2~{S})-2-azanyl-3-methyl-butyl]carbamic acid
UU4
UU4
Name:(2S)-2-amino-4-(L-serylamino)butanoic acid
Formula:C7 H15 N3 O4
SMILES:O=C(NCCC(C(=O)O)N)C(N)CO
InChi:InChI=1S/C7H15N3O4/c8-4(7(13)14)1-2-10-6(12)5(9)3-11/h4-5,11H,1-3,8-9H2,(H,10,12)(H,13,14)/t4-,5-/m0/s1
Definition date:2012-11-14
Last modified:2023-11-03
Release date:2013-08-21
Identifier:(2S)-2-amino-4-(L-serylamino)butanoic acid
UU5
UU5
Name:(2S)-2-amino-4-[(oxoacetyl)amino]butanoic acid
Formula:C6 H10 N2 O4
SMILES:O=C(O)C(N)CCNC(=O)C=O
InChi:InChI=1S/C6H10N2O4/c7-4(6(11)12)1-2-8-5(10)3-9/h3-4H,1-2,7H2,(H,8,10)(H,11,12)/t4-/m0/s1
Definition date:2012-11-12
Last modified:2023-11-03
Release date:2013-08-21
Identifier:(2S)-2-amino-4-[(oxoacetyl)amino]butanoic acid
UX8
UX8
Name:(2~{S},3~{R})-2-azanyl-3-(1~{H}-indol-3-yl)-3-oxidanyl-propanoic acid
Formula:C11 H12 N2 O3
SMILES:N[CH]([CH](O)c1c[nH]c2ccccc12)C(O)=O
InChi:InChI=1S/C11H12N2O3/c12-9(11(15)16)10(14)7-5-13-8-4-2-1-3-6(7)8/h1-5,9-10,13-14H,12H2,(H,15,16)/t9-,10+/m0/s1
Definition date:2021-03-25
Last modified:2023-11-03
Release date:2021-04-21
Identifier:(2~{S},3~{R})-2-azanyl-3-(1~{H}-indol-3-yl)-3-oxidanyl-propanoic acid
UXQ
UXQ
Name:(2S)-2-azanyl-3-[4-[(2-chloranylethanoylamino)methyl]phenyl]propanoic acid
Formula:C12 H15 Cl N2 O3
SMILES:N[CH](Cc1ccc(CNC(=O)CCl)cc1)C(O)=O
InChi:InChI=1S/C12H15ClN2O3/c13-6-11(16)15-7-9-3-1-8(2-4-9)5-10(14)12(17)18/h1-4,10H,5-7,14H2,(H,15,16)(H,17,18)/t10-/m0/s1
Definition date:2021-03-26
Last modified:2023-11-03
Release date:2021-10-13
Identifier:(2~{S})-2-azanyl-3-[4-[(2-chloranylethanoylamino)methyl]phenyl]propanoic acid
UXS
UXS
Name:(2S)-2-amino-4-(methylsulfanyl)butan-1-ol
Formula:C5 H13 N O S
SMILES:C(C(N)CCSC)O
InChi:InChI=1S/C5H13NOS/c1-8-3-2-5(6)4-7/h5,7H,2-4,6H2,1H3/t5-/m0/s1
Definition date:2020-06-04
Last modified:2023-11-03
Release date:2020-06-17
Identifier:(2S)-2-amino-4-(methylsulfanyl)butan-1-ol
UXY
UXY
Name:(4R)-4-hydroxy-L-lysine
Formula:C6 H14 N2 O3
SMILES:NC(C(O)=O)CC(CCN)O
InChi:InChI=1S/C6H14N2O3/c7-2-1-4(9)3-5(8)6(10)11/h4-5,9H,1-3,7-8H2,(H,10,11)/t4-,5+/m1/s1
Definition date:2020-06-04
Last modified:2023-11-03
Release date:2020-10-07
Identifier:(4R)-4-hydroxy-L-lysine
UZ1
UZ1
Name:cyclopropanamine
Formula:C3 H7 N
SMILES:NC1CC1
InChi:InChI=1S/C3H7N/c4-3-1-2-3/h3H,1-2,4H2
Definition date:2020-06-08
Last modified:2023-11-03
Release date:2020-06-17
Identifier:cyclopropanamine
UZ4
UZ4
Name:(2R,3S)-3-amino-2-hydroxy-4-[(3S)-2-oxopyrrolidin-3-yl]butanoic acid
Formula:C8 H14 N2 O4
SMILES:NC(C(O)C(O)=O)CC1CCNC1=O
InChi:InChI=1S/C8H14N2O4/c9-5(6(11)8(13)14)3-4-1-2-10-7(4)12/h4-6,11H,1-3,9H2,(H,10,12)(H,13,14)/t4-,5-,6+/m0/s1
Definition date:2020-06-08
Last modified:2023-11-03
Release date:2020-06-17
Identifier:(2R,3S)-3-amino-2-hydroxy-4-[(3S)-2-oxopyrrolidin-3-yl]butanoic acid
UZ7
UZ7
Name:phenyl hydrogen carbonate
Formula:C7 H6 O3
SMILES:c1cc(ccc1)OC(O)=O
InChi:InChI=1S/C7H6O3/c8-7(9)10-6-4-2-1-3-5-6/h1-5H,(H,8,9)
Definition date:2020-06-08
Last modified:2023-11-03
Release date:2020-06-17
Identifier:phenyl hydrogen carbonate
UZA
UZA
Name:(2S,6E)-2-amino-2-methylnon-6-enoic acid
Formula:C10 H19 N O2
SMILES:NC(C(=O)O)(C)CCCC=CCC
InChi:InChI=1S/C10H19NO2/c1-3-4-5-6-7-8-10(2,11)9(12)13/h4-5H,3,6-8,11H2,1-2H3,(H,12,13)/b5-4+/t10-/m0/s1
Definition date:2020-06-08
Last modified:2023-11-03
Release date:2020-07-22
Identifier:(2S,6E)-2-amino-2-methylnon-6-enoic acid
UZN
UZN
Name:[(2~{S})-2-azanylhexyl]carbamic acid
Formula:C7 H16 N2 O2
SMILES:CCCC[CH](N)CNC(O)=O
InChi:InChI=1S/C7H16N2O2/c1-2-3-4-6(8)5-9-7(10)11/h6,9H,2-5,8H2,1H3,(H,10,11)/t6-/m0/s1
Definition date:2019-10-12
Last modified:2023-11-03
Release date:2021-02-17
Identifier:[(2~{S})-2-azanylhexyl]carbamic acid
V1V
V1V
Name:(2S,3S)-3-amino-2-hydroxyhexanoic acid
Formula:C6 H13 N O3
SMILES:CCCC(N)C(O)C(O)=O
InChi:InChI=1S/C6H13NO3/c1-2-3-4(7)5(8)6(9)10/h4-5,8H,2-3,7H2,1H3,(H,9,10)/t4-,5-/m0/s1
Definition date:2020-06-16
Last modified:2023-11-03
Release date:2020-06-24
Identifier:(2S,3S)-3-amino-2-hydroxyhexanoic acid
V4F
V4F
Name:8-(aminomethyl)-4-(phosphonomethoxy)quinoline-2-carboxylic acid
Formula:C12 H13 N2 O6 P
SMILES:NCc1cccc2c(OC[P](O)(O)=O)cc(nc12)C(O)=O
InChi:InChI=1S/C12H13N2O6P/c13-5-7-2-1-3-8-10(20-6-21(17,18)19)4-9(12(15)16)14-11(7)8/h1-4H,5-6,13H2,(H,15,16)(H2,17,18,19)
Definition date:2023-02-21
Last modified:2023-11-03
Release date:2023-07-19
Identifier:8-(aminomethyl)-4-(phosphonomethoxy)quinoline-2-carboxylic acid

222926

數據於2024-07-24公開中

PDB statisticsPDBj update infoContact PDBjnumon