Chemie Search results for query - 日本蛋白质结构数据库

English 日本語简体中文繁體中文 한국어

✖

Menu

RCSB PDB PDBe BMRB Adv. Search Search help

PDB Info pages Status search Chemie search: 39937 results BIRD

EXL

EXL
Name:	1-Methyl-L-tryptophan
Formula:	C12 H14 N2 O2
SMILES:	Cn1cc(C[CH](N)C(O)=O)c2ccccc12
InChi:	InChI=1S/C12H14N2O2/c1-14-7-8(6-10(13)12(15)16)9-4-2-3-5-11(9)14/h2-5,7,10H,6,13H2,1H3,(H,15,16)/t10-/m0/s1
Synonyms:	(2S)-2-azanyl-3-(1-methylindol-3-yl)propanoic acid
Definition date:	2020-02-14
Last modified:	2023-11-03
Release date:	2020-07-08
Identifier:	(2~{S})-2-azanyl-3-(1-methylindol-3-yl)propanoic acid

EYG

EYG
Name:	{(2R,4Z)-2-[(1R)-1-amino-3-(methylsulfanyl)propyl]-2-hydroxy-4-[(4-hydroxyphenyl)methylidene]-5-oxoimidazolidin-1-yl}acetic acid
Formula:	C16 H21 N3 O5 S
SMILES:	O=C(O)CN1C(=O)/C(NC1(O)C(N)CCSC)=C/c2ccc(O)cc2
InChi:	InChI=1S/C16H21N3O5S/c1-25-7-6-13(17)16(24)18-12(15(23)19(16)9-14(21)22)8-10-2-4-11(20)5-3-10/h2-5,8,13,18,20,24H,6-7,9,17H2,1H3,(H,21,22)/b12-8-/t13-,16-/m1/s1
Synonyms:	CHROMOPHORE (MET-TYR-GLY)
Definition date:	2010-08-24
Last modified:	2023-11-03
Identifier:	[(2R,4Z)-2-[(1R)-1-amino-3-(methylsulfanyl)propyl]-2-hydroxy-4-(4-hydroxybenzylidene)-5-oxoimidazolidin-1-yl]acetic acid

EYZ

EYZ
Name:	(2~{S})-2-azanyl-6-[[(3~{R})-4-oxidanyl-4-oxidanylidene-3-phenylsulfanyl-butanoyl]amino]hexanoic acid
Formula:	C16 H22 N2 O5 S
SMILES:	N[CH](CCCCNC(=O)C[CH](Sc1ccccc1)C(O)=O)C(O)=O
InChi:	InChI=1S/C16H22N2O5S/c17-12(15(20)21)8-4-5-9-18-14(19)10-13(16(22)23)24-11-6-2-1-3-7-11/h1-3,6-7,12-13H,4-5,8-10,17H2,(H,18,19)(H,20,21)(H,22,23)/t12-,13+/m0/s1
Definition date:	2018-05-08
Last modified:	2023-11-03
Release date:	2018-05-16
Identifier:	(2~{S})-2-azanyl-6-[[(3~{R})-4-oxidanyl-4-oxidanylidene-3-phenylsulfanyl-butanoyl]amino]hexanoic acid

EZY

EZY
Name:	N-[(2-nitrophenyl)methyl]glycine
Formula:	C9 H10 N2 O4
SMILES:	N(CC(=O)O)Cc1c(N(=O)=O)cccc1
InChi:	InChI=1S/C9H10N2O4/c12-9(13)6-10-5-7-3-1-2-4-8(7)11(14)15/h1-4,10H,5-6H2,(H,12,13)
Synonyms:	2-nitrobenzylglycine
Definition date:	2018-02-20
Last modified:	2023-11-03
Release date:	2018-05-16
Identifier:	N-[(2-nitrophenyl)methyl]glycine

F2F

F2F
Name:	3,4-difluoro-L-phenylalanine
Formula:	C9 H9 F2 N O2
SMILES:	Fc1ccc(cc1F)CC(C(=O)O)N
InChi:	InChI=1S/C9H9F2NO2/c10-6-2-1-5(3-7(6)11)4-8(12)9(13)14/h1-3,8H,4,12H2,(H,13,14)/t8-/m0/s1
Definition date:	2008-05-20
Last modified:	2023-11-03
Identifier:	3,4-difluoro-L-phenylalanine

F2Y

F2Y
Name:	3,5-difluoro-L-tyrosine
Formula:	C9 H9 F2 N O3
SMILES:	Fc1cc(cc(F)c1O)CC(C(=O)O)N
InChi:	InChI=1S/C9H9F2NO3/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,7,13H,3,12H2,(H,14,15)/t7-/m0/s1
Definition date:	2012-10-25
Last modified:	2023-11-03
Release date:	2013-03-13
Identifier:	3,5-difluoro-L-tyrosine

HZP

HZP
Name:	(4S)-4-hydroxy-L-proline
Formula:	C5 H9 N O3
SMILES:	O=C(O)C1NCC(O)C1
InChi:	InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4-/m0/s1
Definition date:	2009-04-16
Last modified:	2023-11-03
Identifier:	(4S)-4-hydroxy-L-proline

I0C

I0C
Name:	(2~{S})-4-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-[3-[[9-[(2~{R},5~{R})-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-7~{H}-purin-6-yl]amino]propyl]amino]-2-azanyl-butanoic acid
Formula:
SMILES:	N[CH](CCN(CCCNc1ncnc2n(cnc12)C3OC(CO)C(O)C3O)C[CH]4O[CH]([CH](O)[CH]4O)n5cnc6c(N)ncnc56)C(O)=O
InChi:	InChI=1S/C27H38N12O9/c28-12(27(45)46)2-5-37(6-13-17(41)19(43)25(47-13)38-10-35-15-21(29)31-8-33-23(15)38)4-1-3-30-22-16-24(34-9-32-22)39(11-36-16)26-20(44)18(42)14(7-40)48-26/h8-14,17-20,25-26,40-44H,1-7,28H2,(H,45,46)(H2,29,31,33)(H,30,32,34)/t12-,13+,14?,17+,18?,19+,20?,25+,26?/m0/s1
Definition date:	2023-07-24
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(2~{S})-4-[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl-[3-[[9-[(2~{R},3~{R},4~{S},5~{R})-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-6-yl]amino]propyl]amino]-2-azanyl-butanoic acid

I1C

I1C
Name:	{(4Z)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-[(4-hydroxy-3-iodophenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid
Formula:	C15 H16 I N3 O5
SMILES:	C(O)(C)C(C2=NC(=[C@H]c1cc(I)c(cc1)O)C(N2CC(O)=O)=O)N
InChi:	InChI=1S/C15H16IN3O5/c1-7(20)13(17)14-18-10(15(24)19(14)6-12(22)23)5-8-2-3-11(21)9(16)4-8/h2-5,7,13,20-21H,6,17H2,1H3,(H,22,23)/b10-5-/t7-,13+/m1/s1
Definition date:	2019-04-02
Last modified:	2023-11-03
Release date:	2020-04-08
Identifier:	{(4Z)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-[(4-hydroxy-3-iodophenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid

I2F

I2F
Name:	(2~{S},4~{R},5~{E})-5-[(5~{S})-5-azanyl-6-oxidanyl-hexyl]iminohexane-1,2,4-triol
Formula:	C12 H26 N2 O5
SMILES:	CC(=NCCCC[CH](N)C(O)O)[CH](O)C[CH](O)CO
InChi:	InChI=1S/C12H26N2O5/c1-8(11(17)6-9(16)7-15)14-5-3-2-4-10(13)12(18)19/h9-12,15-19H,2-7,13H2,1H3/b14-8+/t9-,10-,11+/m0/s1
Definition date:	2022-02-08
Last modified:	2023-11-03
Release date:	2023-02-08
Identifier:	(2~{S},4~{R},5~{E})-5-[(5~{S})-5-azanyl-6,6-bis(oxidanyl)hexyl]iminohexane-1,2,4-triol

I2J

I2J
Name:	2-(2-aminoethoxy)ethan-1-ol
Formula:	C4 H11 N O2
SMILES:	NCCOCCO
InChi:	InChI=1S/C4H11NO2/c5-1-3-7-4-2-6/h6H,1-5H2
Definition date:	2022-01-07
Last modified:	2023-11-03
Release date:	2022-08-03
Identifier:	2-(2-aminoethoxy)ethan-1-ol

I2M

I2M
Name:	3-methyl-L-alloisoleucine
Formula:	C7 H15 N O2
SMILES:	O=C(O)C(N)C(C)(CC)C
InChi:	InChI=1S/C7H15NO2/c1-4-7(2,3)5(8)6(9)10/h5H,4,8H2,1-3H3,(H,9,10)/t5-/m1/s1
Synonyms:	beta-methylisoleucine
Definition date:	2008-06-01
Last modified:	2023-11-03
Identifier:	3-methyl-L-alloisoleucine

I3D

I3D
Name:	5,6-difluoro-tryptophan
Formula:	C11 H10 F2 N2 O2
SMILES:	N[CH](Cc1c[nH]c2cc(F)c(F)cc12)C(O)=O
InChi:	InChI=1S/C11H10F2N2O2/c12-7-2-6-5(1-9(14)11(16)17)4-15-10(6)3-8(7)13/h2-4,9,15H,1,14H2,(H,16,17)/t9-/m0/s1
Synonyms:	(2S)-2-azanyl-3-[5,6-bis(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-bis(fluoranyl)-1~{H}-indol-3-yl]propanoic acid

I4G

I4G
Name:	N-(2-methylpropyl)glycine
Formula:	C6 H13 N O2
SMILES:	O=C(O)CNCC(C)C
InChi:	InChI=1S/C6H13NO2/c1-5(2)3-7-4-6(8)9/h5,7H,3-4H2,1-2H3,(H,8,9)
Definition date:	2014-04-04
Last modified:	2023-11-03
Release date:	2014-07-23
Identifier:	N-(2-methylpropyl)glycine

I4O

I4O
Name:	Histidine oxo-vanadium complex
Formula:	C6 H8 N3 O6 V
SMILES:	N[CH](Cc1cn(cn1)[V]([O-])([O-])([O-])=O)C(O)=O
InChi:	InChI=1S/C6H9N3O2.4O.V/c7-5(6(10)11)1-4-2-8-3-9-4
Synonyms:	[4-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]imidazol-1-yl]-tris(oxidanidyl)-oxidanylidene-vanadium
Definition date:	2022-02-11
Last modified:	2023-11-03
Release date:	2023-02-01
Identifier:	[4-[(2~{S})-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]imidazol-1-yl]-tris(oxidanidyl)-oxidanylidene-vanadium

I7F

I7F
Name:	O-hydroxy-L-serine
Formula:	C3 H7 N O4
SMILES:	N[CH](COO)C(O)=O
InChi:	InChI=1S/C3H7NO4/c4-2(1-8-7)3(5)6/h2,7H,1,4H2,(H,5,6)/t2-/m0/s1
Synonyms:	(2S)-2-amino-3-hydroperoxypropanoic acid
Definition date:	2022-02-17
Last modified:	2023-11-03
Release date:	2022-10-26
Identifier:	(2~{S})-2-azanyl-3-(dioxidanyl)propanoic acid

IAE

IAE
Name:	(2S)-2-azanyl-4-[4-(trifluoromethyl)phenyl]butanoic acid
Formula:	C11 H12 F3 N O2
SMILES:	N[CH](CCc1ccc(cc1)C(F)(F)F)C(O)=O
InChi:	InChI=1S/C11H12F3NO2/c12-11(13,14)8-4-1-7(2-5-8)3-6-9(15)10(16)17/h1-2,4-5,9H,3,6,15H2,(H,16,17)/t9-/m0/s1
Definition date:	2022-06-23
Last modified:	2023-11-03
Release date:	2023-07-26
Identifier:	(2~{S})-2-azanyl-4-[4-(trifluoromethyl)phenyl]butanoic acid

IAM

IAM
Name:	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE
Formula:	C13 H20 N2 O2
SMILES:	O=C(O)C(N)Cc1ccc(cc1)CNC(C)C
InChi:	InChI=1S/C13H20N2O2/c1-9(2)15-8-11-5-3-10(4-6-11)7-12(14)13(16)17/h3-6,9,12,15H,7-8,14H2,1-2H3,(H,16,17)/t12-/m0/s1
Definition date:	2004-11-19
Last modified:	2023-11-03
Identifier:	4-{[(1-methylethyl)amino]methyl}-L-phenylalanine

IAR

IAR
Name:	(2E)-5-[(diaminomethylidene)amino]-2-iminopentanoic acid
Formula:	C6 H12 N4 O2
SMILES:	O=C(O)C(=[N@H])CCCNC(=[N@H])N
InChi:	InChI=1S/C6H12N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h7H,1-3H2,(H,11,12)(H4,8,9,10)/b7-4+
Definition date:	2010-07-20
Last modified:	2023-11-03
Identifier:	(2E)-5-carbamimidamido-2-iminopentanoic acid

IAS

IAS
Name:	BETA-L-ASPARTIC ACID
Formula:	C4 H7 N O4
SMILES:	O=C(O)CC(N)C(=O)O
InChi:	InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1
Synonyms:	L-aspartic acid
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	L-aspartic acid

IB9

IB9
Name:	Beta-tyrosine
Formula:	C9 H11 N O3
SMILES:	N[CH](CC(O)=O)c1ccc(O)cc1
InChi:	InChI=1S/C9H11NO3/c10-8(5-9(12)13)6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1
Synonyms:	(3S)-3-azanyl-3-(4-hydroxyphenyl)propanoic acid
Definition date:	2022-03-08
Last modified:	2023-11-03
Release date:	2023-01-18
Identifier:	(3~{S})-3-azanyl-3-(4-hydroxyphenyl)propanoic acid

IBU

IBU
Name:	2-methylpropyl hydrogen carbonate
Formula:	C5 H10 O3
SMILES:	O=C(O)OCC(C)C
InChi:	InChI=1S/C5H10O3/c1-4(2)3-8-5(6)7/h4H,3H2,1-2H3,(H,6,7)
Definition date:	2008-03-14
Last modified:	2023-11-03
Identifier:	2-methylpropyl hydrogen carbonate

IC0

IC0
Name:	Fmoc-(S)-2-(4-pentenyl)-glycine
Formula:	C7 H13 N O2
SMILES:	N[CH](CCCC=C)C(O)=O
InChi:	InChI=1S/C7H13NO2/c1-2-3-4-5-6(8)7(9)10/h2,6H,1,3-5,8H2,(H,9,10)/t6-/m0/s1
Synonyms:	(2S)-2-azanylhept-6-enoic acid
Definition date:	2022-03-08
Last modified:	2023-11-03
Release date:	2022-05-18
Identifier:	(2~{S})-2-azanylhept-6-enoic acid

4DB

4DB
Name:	(2S)-2-amino-4-[5-(dimethylamino)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]butanoic acid
Formula:	C14 H17 N3 O4
SMILES:	O=C(O)C(N)CCN2C(=O)c1ccc(cc1C2=O)N(C)C
InChi:	InChI=1S/C14H17N3O4/c1-16(2)8-3-4-9-10(7-8)13(19)17(12(9)18)6-5-11(15)14(20)21/h3-4,7,11H,5-6,15H2,1-2H3,(H,20,21)/t11-/m0/s1
Definition date:	2009-09-23
Last modified:	2023-11-03
Identifier:	(2S)-2-amino-4-[5-(dimethylamino)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]butanoic acid

4DP

4DP
Name:	3-[5-(DIMETHYLAMINO)-1,3-DIOXO-1,3-DIHYDRO-2H-ISOINDOL-2-YL]-L-ALANINE
Formula:	C13 H15 N3 O4
SMILES:	O=C(O)C(N)CN2C(=O)c1ccc(cc1C2=O)N(C)C
InChi:	InChI=1S/C13H15N3O4/c1-15(2)7-3-4-8-9(5-7)12(18)16(11(8)17)6-10(14)13(19)20/h3-5,10H,6,14H2,1-2H3,(H,19,20)/t10-/m0/s1
Synonyms:	4-(N,N-DIMETHYLAMINO)PHTHALIMIDOALANYL
Definition date:	2006-10-25
Last modified:	2023-11-03
Identifier:	3-[5-(dimethylamino)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]-L-alanine

<133 134 135 136 137 138 139140141 142 143 144 145 146 147 148 >

223532

数据于2024-08-07公开中

PDB statistics

PDBj update info

Contact PDBj

numon