Chemie Search results for query - Protein Data Bank Japan

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: 43884 results BIRD

2KY

2KY
Name:	(2S)-amino(cyclopentyl)ethanoic acid
Formula:	C7 H13 N O2
SMILES:	O=C(O)C(N)C1CCCC1
InChi:	InChI=1S/C7H13NO2/c8-6(7(9)10)5-3-1-2-4-5/h5-6H,1-4,8H2,(H,9,10)/t6-/m0/s1
Definition date:	2013-11-22
Last modified:	2024-09-27
Release date:	2018-02-28
Identifier:	(2S)-amino(cyclopentyl)ethanoic acid

2L0

2L0
Name:	N-[(benzyloxy)carbonyl]-L-leucyl-N-[(2R,3S,4S)-1,3-dihydroxy-2,6-dimethylheptan-4-yl]-L-leucinamide
Formula:	C29 H49 N3 O6
SMILES:	O=C(NC(CC(C)C)C(O)C(C)CO)C(NC(=O)C(NC(=O)OCc1ccccc1)CC(C)C)CC(C)C
InChi:	InChI=1S/C29H49N3O6/c1-18(2)13-23(26(34)21(7)16-33)30-27(35)24(14-19(3)4)31-28(36)25(15-20(5)6)32-29(37)38-17-22-11-9-8-10-12-22/h8-12,18-21,23-26,33-34H,13-17H2,1-7H3,(H,30,35)(H,31,36)(H,32,37)/t21-,23+,24+,25+,26+/m1/s1
Synonyms:	PHQ-LEU-LEU-LEU-EPOXYKETONE, bound form
Definition date:	2013-11-25
Last modified:	2024-09-27
Release date:	2014-02-12
Identifier:	N-[(benzyloxy)carbonyl]-L-leucyl-N-[(2R,3S,4S)-1,3-dihydroxy-2,6-dimethylheptan-4-yl]-L-leucinamide

2L4

2L4
Name:	1-deoxy-1-({2,6-dioxo-5-[(E)-(2-oxoethylidene)amino]-1,2,3,6-tetrahydropyrimidin-4-yl}amino)-D-ribitol
Formula:	C11 H16 N4 O7
SMILES:	O=C1NC(NCC(O)C(O)C(O)CO)=C(N=CC=O)C(=O)N1
InChi:	InChI=1S/C11H16N4O7/c16-2-1-12-7-9(14-11(22)15-10(7)21)13-3-5(18)8(20)6(19)4-17/h1-2,5-6,8,17-20H,3-4H2,(H3,13,14,15,21,22)/b12-1+/t5-,6+,8-/m0/s1
Synonyms:	5-(2-oxoethylideneamino)-6-D-ribitylaminouracil
Definition date:	2013-11-25
Last modified:	2024-09-27
Release date:	2014-04-16
Identifier:	1-deoxy-1-({2,6-dioxo-5-[(E)-(2-oxoethylidene)amino]-1,2,3,6-tetrahydropyrimidin-4-yl}amino)-D-ribitol

2L5

2L5
Name:	2-chloro-L-phenylalanine
Formula:	C9 H10 Cl N O2
SMILES:	Clc1ccccc1CC(C(=O)O)N
InChi:	InChI=1S/C9H10ClNO2/c10-7-4-2-1-3-6(7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m0/s1
Definition date:	2013-11-25
Last modified:	2024-09-27
Release date:	2014-10-15
Identifier:	2-chloro-L-phenylalanine

2L6

2L6
Name:	(3S,6R,8aS)-5-oxo-1,2,3,8a-tetrahydrospiro[indolizine-6,2'-pyrrolidine]-3-carboxylic acid
Formula:	C12 H16 N2 O3
SMILES:	O=C(O)C3N2C(=O)C1(NCCC1)C=CC2CC3
InChi:	InChI=1S/C12H16N2O3/c15-10(16)9-3-2-8-4-6-12(5-1-7-13-12)11(17)14(8)9/h4,6,8-9,13H,1-3,5,7H2,(H,15,16)/t8-,9-,12+/m0/s1
Definition date:	2013-11-25
Last modified:	2024-09-27
Release date:	2014-10-15
Identifier:	(3S,6R,8aS)-5-oxo-1,2,3,8a-tetrahydrospiro[indolizine-6,2'-pyrrolidine]-3-carboxylic acid

TPJ

TPJ
Name:	(5R)-5-tert-butyl-L-proline
Formula:	C9 H17 N O2
SMILES:	O=C(O)C1NC(C(C)(C)C)CC1
InChi:	InChI=1S/C9H17NO2/c1-9(2,3)7-5-4-6(10-7)8(11)12/h6-7,10H,4-5H2,1-3H3,(H,11,12)/t6-,7+/m0/s1
Definition date:	2012-03-15
Last modified:	2024-09-27
Identifier:	(5R)-5-tert-butyl-L-proline

TPL

TPL
Name:	TRYPTOPHANOL
Formula:	C11 H14 N2 O
SMILES:	OCC(N)Cc2c1ccccc1nc2
InChi:	InChI=1S/C11H14N2O/c12-9(7-14)5-8-6-13-11-4-2-1-3-10(8)11/h1-4,6,9,13-14H,5,7,12H2/t9-/m0/s1
Synonyms:	2-AMINO-3-(1H-INDOL-3-YL)-PROPAN-1-OL
Definition date:	2000-02-08
Last modified:	2024-09-27
Identifier:	(2S)-2-amino-3-(1H-indol-3-yl)propan-1-ol

TPN

TPN
Name:	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-THYMINE
Formula:	C11 H17 N4 O5
SMILES:	O=C(N(CC(=O)O)CC[NH3+])CN1C=C(C(=O)NC1=O)C
InChi:	InChI=1S/C11H16N4O5/c1-7-4-15(11(20)13-10(7)19)5-8(16)14(3-2-12)6-9(17)18/h4H,2-3,5-6,12H2,1H3,(H,17,18)(H,13,19,20)/p+1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	2-{(carboxymethyl)[(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)acetyl]amino}ethanaminium

TPO

TPO
Name:	PHOSPHOTHREONINE
Formula:	C4 H10 N O6 P
SMILES:	O=P(O)(O)OC(C(N)C(=O)O)C
InChi:	InChI=1S/C4H10NO6P/c1-2(3(5)4(6)7)11-12(8,9)10/h2-3H,5H2,1H3,(H,6,7)(H2,8,9,10)/t2-,3+/m1/s1
Synonyms:	PHOSPHONOTHREONINE
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	O-phosphono-L-threonine

TPQ

TPQ
Name:	5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-1,4-BENZOQUINONE
Formula:	C9 H9 N O5
SMILES:	O=C1C(=CC(=O)C(O)=C1)CC(C(=O)O)N
InChi:	InChI=1S/C9H9NO5/c10-5(9(14)15)1-4-2-7(12)8(13)3-6(4)11/h2-3,5,13H,1,10H2,(H,14,15)/t5-/m0/s1
Synonyms:	5-(2-CARBOXY-2-AMINOETHYL)-4-HYDROXY-1,2-BENZOQUINONE
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	3-(4-hydroxy-3,6-dioxocyclohexa-1,4-dien-1-yl)-L-alanine

2LJ

2LJ
Name:	1-deoxy-1-({2,6-dioxo-5-[(E)-propylideneamino]-1,2,3,6-tetrahydropyrimidin-4-yl}amino)-D-ribitol
Formula:	C12 H20 N4 O6
SMILES:	C1(=O)NC(NC(=C1N=CCC)NCC(O)C(O)C(O)CO)=O
InChi:	InChI=1S/C12H20N4O6/c1-2-3-13-8-10(15-12(22)16-11(8)21)14-4-6(18)9(20)7(19)5-17/h3,6-7,9,17-20H,2,4-5H2,1H3,(H3,14,15,16,21,22)/b13-3+/t6-,7+,9-/m0/s1
Synonyms:	5-(2-oxopropylideneamino)-6-D-ribitylaminouracil
Definition date:	2013-11-27
Last modified:	2024-09-27
Release date:	2014-04-16
Identifier:	1-deoxy-1-({2,6-dioxo-5-[(E)-propylideneamino]-1,2,3,6-tetrahydropyrimidin-4-yl}amino)-D-ribitol

TPX

TPX
Name:	(2S,3S)-3-FORMYL-2-({[(4-METHYLPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACID
Formula:	C14 H19 N O5 S
SMILES:	O=S(=O)(c1ccc(cc1)C)NCC(C(=O)O)C(C=O)CC
InChi:	InChI=1S/C14H19NO5S/c1-3-11(9-16)13(14(17)18)8-15-21(19,20)12-6-4-10(2)5-7-12/h4-7,9,11,13,15H,3,8H2,1-2H3,(H,17,18)/t11-,13-/m1/s1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	(2S,3S)-3-formyl-2-({[(4-methylphenyl)sulfonyl]amino}methyl)pentanoic acid

TPY

TPY
Name:	(2S,3S)-3-FORMYL-2-({[(4-NITROPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACID
Formula:	C13 H16 N2 O7 S
SMILES:	O=S(=O)(NCC(C(=O)O)C(C=O)CC)c1ccc([N+]([O-])=O)cc1
InChi:	InChI=1S/C13H16N2O7S/c1-2-9(8-16)12(13(17)18)7-14-23(21,22)11-5-3-10(4-6-11)15(19)20/h3-6,8-9,12,14H,2,7H2,1H3,(H,17,18)/t9-,12-/m1/s1
Definition date:	2000-06-09
Last modified:	2024-09-27
Identifier:	(2S,3S)-3-formyl-2-({[(4-nitrophenyl)sulfonyl]amino}methyl)pentanoic acid

2LR

2LR
Name:	N-[(benzyloxy)carbonyl]-L-leucyl-N-{(1R,2S)-1-hydroxy-4-methyl-1-[(2R)-2-methyloxiran-2-yl]pentan-2-yl}-L-leucinamide
Formula:	C29 H47 N3 O6
SMILES:	O=C(OCc1ccccc1)NC(C(=O)NC(C(=O)NC(C(O)C2(OC2)C)CC(C)C)CC(C)C)CC(C)C
InChi:	InChI=1S/C29H47N3O6/c1-18(2)13-22(25(33)29(7)17-38-29)30-26(34)23(14-19(3)4)31-27(35)24(15-20(5)6)32-28(36)37-16-21-11-9-8-10-12-21/h8-12,18-20,22-25,33H,13-17H2,1-7H3,(H,30,34)(H,31,35)(H,32,36)/t22-,23-,24-,25+,29+/m0/s1
Synonyms:	PHQ-LEU-LEU-LEU-EPOXYKETONE, unbound form
Definition date:	2013-11-28
Last modified:	2024-09-27
Release date:	2014-02-12
Identifier:	N-[(benzyloxy)carbonyl]-L-leucyl-N-{(1R,2S)-1-hydroxy-4-methyl-1-[(2R)-2-methyloxiran-2-yl]pentan-2-yl}-L-leucinamide

2LT

2LT
Name:	3,5-dichloro-L-tyrosine
Formula:	C9 H9 Cl2 N O3
SMILES:	Clc1cc(cc(Cl)c1O)CC(C(=O)O)N
InChi:	InChI=1S/C9H9Cl2NO3/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:	2013-12-18
Last modified:	2024-09-27
Release date:	2014-09-24
Identifier:	3,5-dichloro-L-tyrosine

2LV

2LV
Name:	N-[(benzyloxy)carbonyl]-L-leucyl-N-[(2S,3S)-2-hydroxy-5-methyl-1-oxo-1-(phenylamino)hexan-3-yl]-L-leucinamide
Formula:	C33 H48 N4 O6
SMILES:	O=C(Nc1ccccc1)C(O)C(NC(=O)C(NC(=O)C(NC(=O)OCc2ccccc2)CC(C)C)CC(C)C)CC(C)C
InChi:	InChI=1S/C33H48N4O6/c1-21(2)17-26(29(38)32(41)34-25-15-11-8-12-16-25)35-30(39)27(18-22(3)4)36-31(40)28(19-23(5)6)37-33(42)43-20-24-13-9-7-10-14-24/h7-16,21-23,26-29,38H,17-20H2,1-6H3,(H,34,41)(H,35,39)(H,36,40)(H,37,42)/t26-,27-,28-,29-/m0/s1
Synonyms:	PHQ-Leu-Leu-Leu-ketoamide, bound form
Definition date:	2013-11-29
Last modified:	2024-09-27
Release date:	2014-02-12
Identifier:	N-[(benzyloxy)carbonyl]-L-leucyl-N-[(2S,3S)-2-hydroxy-5-methyl-1-oxo-1-(phenylamino)hexan-3-yl]-L-leucinamide

TQ8

TQ8
Name:	N-[(2S)-4-chloro-3-oxo-1-phenyl-butan-2-yl]-4-methyl-benzenesulfonamide
Formula:	C17 H18 Cl N O3 S
SMILES:	Cc1ccc(cc1)[S](=O)(=O)N[CH](Cc2ccccc2)C(=O)CCl
InChi:	InChI=1S/C17H18ClNO3S/c1-13-7-9-15(10-8-13)23(21,22)19-16(17(20)12-18)11-14-5-3-2-4-6-14/h2-10,16,19H,11-12H2,1H3/t16-/m0/s1
Synonyms:	CAS329306
Definition date:	2010-11-17
Last modified:	2024-09-27
Identifier:	N-[(2S)-4-chloro-3-oxo-1-phenyl-butan-2-yl]-4-methyl-benzenesulfonamide

TQ9

TQ9
Name:	5-CHLORO-4-OXOPENTANOIC ACID
Formula:	C5 H7 Cl O3
SMILES:	OC(=O)CCC(=O)CCl
InChi:	InChI=1S/C5H7ClO3/c6-3-4(7)1-2-5(8)9/h1-3H2,(H,8,9)
Definition date:	2010-11-17
Last modified:	2024-09-27
Identifier:	5-chloro-4-oxo-pentanoic acid

2M1

2M1
Name:	N-[(benzyloxy)carbonyl]-L-leucyl-N-[(3S)-5-methyl-1-(methylsulfonyl)hexan-3-yl]-L-leucinamide
Formula:	C28 H47 N3 O6 S
SMILES:	O=S(=O)(C)CCC(NC(=O)C(NC(=O)C(NC(=O)OCc1ccccc1)CC(C)C)CC(C)C)CC(C)C
InChi:	InChI=1S/C28H47N3O6S/c1-19(2)15-23(13-14-38(7,35)36)29-26(32)24(16-20(3)4)30-27(33)25(17-21(5)6)31-28(34)37-18-22-11-9-8-10-12-22/h8-12,19-21,23-25H,13-18H2,1-7H3,(H,29,32)(H,30,33)(H,31,34)/t23-,24+,25+/m1/s1
Synonyms:	PHQ-Leu-Leu-Leu-vinylsulfone
Definition date:	2013-12-02
Last modified:	2024-09-27
Release date:	2014-02-12
Identifier:	N-[(benzyloxy)carbonyl]-L-leucyl-N-[(3S)-5-methyl-1-(methylsulfonyl)hexan-3-yl]-L-leucinamide

TQK

TQK
Name:	2-methyl-4-(2-phenylimidazol-1-yl)benzaldehyde
Formula:	C17 H14 N2 O
SMILES:	Cc1cc(ccc1C=O)n2ccnc2c3ccccc3
InChi:	InChI=1S/C17H14N2O/c1-13-11-16(8-7-15(13)12-20)19-10-9-18-17(19)14-5-3-2-4-6-14/h2-12H,1H3
Definition date:	2021-01-12
Last modified:	2024-09-27
Release date:	2021-06-16
Identifier:	2-methyl-4-(2-phenylimidazol-1-yl)benzaldehyde

TQQ

TQQ
Name:	(S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO-7-OXO-1H-INDOL-3-YL)PROPANOIC ACID
Formula:	C11 H11 N3 O3
SMILES:	O=C(O)C(N)Cc2c1C=CC(=[N@H])C(=O)c1nc2
InChi:	InChI=1S/C11H11N3O3/c12-7-2-1-6-5(3-8(13)11(16)17)4-14-9(6)10(7)15/h1-2,4,8,12,14H,3,13H2,(H,16,17)/b12-7-/t8-/m0/s1
Synonyms:	3-[(6E)-6-IMINO-7-OXO-6,7-DIHYDRO-1H-INDOL-3-YL]-L-ALANINE
Definition date:	2005-08-10
Last modified:	2024-09-27
Identifier:	3-[(6Z)-6-imino-7-oxo-6,7-dihydro-1H-indol-3-yl]-L-alanine

2MK

2MK
Name:	N-[(benzyloxy)carbonyl]-L-leucyl-N-[(2R,3S)-1,2-dihydroxy-5-methylhexan-3-yl]-L-leucinamide
Formula:	C27 H45 N3 O6
SMILES:	O=C(NC(CC(C)C)C(O)CO)C(NC(=O)C(NC(=O)OCc1ccccc1)CC(C)C)CC(C)C
InChi:	InChI=1S/C27H45N3O6/c1-17(2)12-21(24(32)15-31)28-25(33)22(13-18(3)4)29-26(34)23(14-19(5)6)30-27(35)36-16-20-10-8-7-9-11-20/h7-11,17-19,21-24,31-32H,12-16H2,1-6H3,(H,28,33)(H,29,34)(H,30,35)/t21-,22-,23-,24-/m0/s1
Synonyms:	PHQ-Leu-Leu-Leu-ketoaldehyde, bound form
Definition date:	2013-12-04
Last modified:	2024-09-27
Release date:	2014-02-12
Identifier:	N-[(benzyloxy)carbonyl]-L-leucyl-N-[(2R,3S)-1,2-dihydroxy-5-methylhexan-3-yl]-L-leucinamide

2ML

2ML
Name:	2-METHYLLEUCINE
Formula:	C7 H15 N O2
SMILES:	O=C(O)C(N)(C)CC(C)C
InChi:	InChI=1S/C7H15NO2/c1-5(2)4-7(3,8)6(9)10/h5H,4,8H2,1-3H3,(H,9,10)/t7-/m0/s1
Definition date:	2001-02-08
Last modified:	2024-09-27
Identifier:	2-methyl-L-leucine

TQV

TQV
Name:	O-CRESYL-SALIGENIN PHOSPHATE
Formula:	C14 H15 O5 P
SMILES:	O=P(O)(Oc1ccccc1C)OCc2ccccc2O
InChi:	InChI=1S/C14H15O5P/c1-11-6-2-5-9-14(11)19-20(16,17)18-10-12-7-3-4-8-13(12)15/h2-9,15H,10H2,1H3,(H,16,17)
Definition date:	2012-10-03
Last modified:	2024-09-27
Release date:	2013-02-01
Identifier:	2-hydroxybenzyl 2-methylphenyl hydrogen (S)-phosphate

2MM

2MM
Name:	N,N-dimethyl-L-methionine
Formula:	C7 H15 N O2 S
SMILES:	O=C(O)C(N(C)C)CCSC
InChi:	InChI=1S/C7H15NO2S/c1-8(2)6(7(9)10)4-5-11-3/h6H,4-5H2,1-3H3,(H,9,10)/t6-/m0/s1
Definition date:	2008-03-14
Last modified:	2024-09-27
Identifier:	N,N-dimethyl-L-methionine

<189 190 191 192 193 194 195196197 198 199 200 201 202 203 204 >

238582

PDB entries from 2025-07-09

PDB statistics

PDBj update info

Contact PDBj

numon