Chemie Search results for query - 日本蛋白質結構資料庫

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: 43892 results BIRD

P2J

P2J
Name:	9-(5-{[(3S)-3-amino-3-carboxypropyl](pentyl)amino}-5-deoxy-beta-L-arabinofuranosyl)-9H-purin-6-amine
Formula:	C19 H31 N7 O5
SMILES:	c2nc(N)c3ncn(C1OC(C(O)C1O)CN(CCC(C(O)=O)N)CCCCC)c3n2
InChi:	InChI=1S/C19H31N7O5/c1-2-3-4-6-25(7-5-11(20)19(29)30)8-12-14(27)15(28)18(31-12)26-10-24-13-16(21)22-9-23-17(13)26/h9-12,14-15,18,27-28H,2-8,20H2,1H3,(H,29,30)(H2,21,22,23)/t11-,12-,14-,15+,18-/m0/s1
Definition date:	2019-07-25
Last modified:	2024-09-27
Release date:	2020-08-19
Identifier:	9-(5-{[(3S)-3-amino-3-carboxypropyl](pentyl)amino}-5-deoxy-beta-L-arabinofuranosyl)-9H-purin-6-amine

AHB

AHB
Name:	BETA-HYDROXYASPARAGINE
Formula:	C4 H8 N2 O4
SMILES:	O=C(O)C(N)C(O)C(=O)N
InChi:	InChI=1S/C4H8N2O4/c5-1(4(9)10)2(7)3(6)8/h1-2,7H,5H2,(H2,6,8)(H,9,10)/t1-,2-/m0/s1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	(3S)-3-hydroxy-L-asparagine

P2Q

P2Q
Name:	2-hydroxy-5-{[(1S,2E)-1-formyl-4-phenoxybut-2-en-1yl]amino}-L-tyrosine
Formula:	C20 H22 N2 O6
SMILES:	N[CH](Cc1cc(N[CH](C=O)C=CCOc2ccccc2)c(O)cc1O)C(O)=O
InChi:	InChI=1S/C20H22N2O6/c21-16(20(26)27)9-13-10-17(19(25)11-18(13)24)22-14(12-23)5-4-8-28-15-6-2-1-3-7-15/h1-7,10-12,14,16,22,24-25H,8-9,21H2,(H,26,27)/b5-4+/t14-,16-/m0/s1
Synonyms:	3-{[(1S,2E)-1-formyl-4-phenoxybut-2-en-1-yl]amino}-6-hydroxy-L-tyrosine
Definition date:	2009-11-10
Last modified:	2024-09-27
Identifier:	(2S)-2-azanyl-3-[2,4-dihydroxy-5-[[(E,2S)-1-oxo-5-phenoxy-pent-3-en-2-yl]amino]phenyl]propanoic acid

AHH

AHH
Name:	AMINO-HYDROXYHEPTANOIC ACID
Formula:	C7 H15 N O3
SMILES:	O=C(O)C(O)C(N)CCCC
InChi:	InChI=1S/C7H15NO3/c1-2-3-4-5(8)6(9)7(10)11/h5-6,9H,2-4,8H2,1H3,(H,10,11)/t5-,6+/m1/s1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	(2S,3R)-3-amino-2-hydroxyheptanoic acid

P2Y

P2Y
Name:	(2S)-PYRROLIDIN-2-YLMETHYLAMINE
Formula:	C5 H12 N2
SMILES:	NCC1NCCC1
InChi:	InChI=1S/C5H12N2/c6-4-5-2-1-3-7-5/h5,7H,1-4,6H2/t5-/m0/s1
Definition date:	2003-03-20
Last modified:	2024-09-27
Identifier:	1-[(2S)-pyrrolidin-2-yl]methanamine

AHO

AHO
Name:	N-ACETYL-N-HYDROXY-L-ORNITHINE
Formula:	C7 H14 N2 O4
SMILES:	O=C(N(O)CCCC(N)C(=O)O)C
InChi:	InChI=1S/C7H14N2O4/c1-5(10)9(13)4-2-3-6(8)7(11)12/h6,13H,2-4,8H2,1H3,(H,11,12)/t6-/m0/s1
Synonyms:	5-(ACETYL-HYDROXY-AMINO)-2-AMINO-PENTANOIC ACID
Definition date:	1999-08-13
Last modified:	2024-09-27
Identifier:	N~5~-acetyl-N~5~-hydroxy-L-ornithine

AHP

AHP
Name:	2-AMINO-HEPTANOIC ACID
Formula:	C7 H15 N O2
SMILES:	O=C(O)C(N)CCCCC
InChi:	InChI=1S/C7H15NO2/c1-2-3-4-5-6(8)7(9)10/h6H,2-5,8H2,1H3,(H,9,10)/t6-/m0/s1
Definition date:	2000-06-15
Last modified:	2024-09-27
Identifier:	(2S)-2-aminoheptanoic acid

AHR

AHR
Name:	alpha-L-arabinofuranose
Formula:	C5 H10 O5
SMILES:	OC1C(OC(O)C1O)CO
InChi:	InChI=1S/C5H10O5/c6-1-2-3(7)4(8)5(9)10-2/h2-9H,1H2/t2-,3-,4+,5+/m0/s1
Synonyms:	alpha-L-arabinose
Definition date:	2002-04-23
Last modified:	2024-09-27
Identifier:	alpha-L-arabinofuranose

AHY

AHY
Name:	(2S,3R)-3-AMINO-2-HYDROXYDECANOIC ACID
Formula:	C10 H21 N O3
SMILES:	O=C(O)C(O)C(N)CCCCCCC
InChi:	InChI=1S/C10H21NO3/c1-2-3-4-5-6-7-8(11)9(12)10(13)14/h8-9,12H,2-7,11H2,1H3,(H,13,14)/t8-,9+/m1/s1
Definition date:	2006-11-06
Last modified:	2024-09-27
Identifier:	(2S,3R)-3-amino-2-hydroxydecanoic acid

AI8

AI8
Name:	Ceftaroline, bound form
Formula:	C22 H23 N8 O5 S4
SMILES:	[O-]C(=O)C=3NC(SCC=3Sc2nc(c1cc[n+](cc1)C)cs2)C(C=O)NC(=O)C(=NOCC)/c4nc(sn4)N
InChi:	InChI=1S/C22H22N8O5S4/c1-3-35-28-16(17-27-21(23)39-29-17)18(32)24-12(8-31)19-26-15(20(33)34)14(10-36-19)38-22-25-13(9-37-22)11-4-6-30(2)7-5-11/h4-9,12,19,26H,3,10H2,1-2H3,(H3-,23,24,27,29,32,33,34)/t12-,19-/m1/s1
Definition date:	2012-12-13
Last modified:	2024-09-27
Release date:	2013-10-09
Identifier:	(2R)-2-[(1R)-1-{[(2Z)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(ethoxyimino)acetyl]amino}-2-oxoethyl]-5-{[4-(1-methylpyridinium-4-yl)-1,3-thiazol-2-yl]sulfanyl}-3,6-dihydro-2H-1,3-thiazine-4-carboxylate

AIA

AIA
Name:	(1S)-2-[(2S,5R)-2-(AMINOMETHYL)-5-ETHYNYLPYRROLIDIN-1-YL]-1-CYCLOPENTYL-2-OXOETHANAMINE
Formula:	C14 H23 N3 O
SMILES:	O=C(N1C(C#C)CCC1CN)C(N)C2CCCC2
InChi:	InChI=1S/C14H23N3O/c1-2-11-7-8-12(9-15)17(11)14(18)13(16)10-5-3-4-6-10/h1,10-13H,3-9,15-16H2/t11-,12-,13-/m0/s1
Definition date:	2006-03-28
Last modified:	2024-09-27
Identifier:	(1S)-2-[(2S,5R)-2-(aminomethyl)-5-ethynylpyrrolidin-1-yl]-1-cyclopentyl-2-oxoethanamine

AIB

AIB
Name:	ALPHA-AMINOISOBUTYRIC ACID
Formula:	C4 H9 N O2
SMILES:	O=C(O)C(N)(C)C
InChi:	InChI=1S/C4H9NO2/c1-4(2,5)3(6)7/h5H2,1-2H3,(H,6,7)
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	2-methyl-L-alanine

P3Q

P3Q
Name:	2-hydroxy-5-{[(1E)-1-(2-oxoethylidene)-4-phenylbutyl]amino}-L-tyrosine
Formula:	C21 H24 N2 O5
SMILES:	N[CH](Cc1cc(NC(CCCc2ccccc2)=CC=O)c(O)cc1O)C(O)=O
InChi:	InChI=1S/C21H24N2O5/c22-17(21(27)28)11-15-12-18(20(26)13-19(15)25)23-16(9-10-24)8-4-7-14-5-2-1-3-6-14/h1-3,5-6,9-10,12-13,17,23,25-26H,4,7-8,11,22H2,(H,27,28)/b16-9+/t17-/m0/s1
Definition date:	2009-11-19
Last modified:	2024-09-27
Identifier:	(2S)-2-azanyl-3-[2,4-dihydroxy-5-[[(E)-1-oxo-6-phenyl-hex-2-en-3-yl]amino]phenyl]propanoic acid

P3T

P3T
Name:	(4-{[(4-AMINOBUTYL)AMINO]METHYL}-5-HYDROXY-6-METHYLPYRIDIN-3-YL)METHYL DIHYDROGEN PHOSPHATE
Formula:	C12 H22 N3 O5 P
SMILES:	O=P(O)(O)OCc1cnc(c(O)c1CNCCCCN)C
InChi:	InChI=1S/C12H22N3O5P/c1-9-12(16)11(7-14-5-3-2-4-13)10(6-15-9)8-20-21(17,18)19/h6,14,16H,2-5,7-8,13H2,1H3,(H2,17,18,19)
Synonyms:	PHOSPHORIC ACID MONO-{4-[(4-AMINO-BUTYLAMINO)-METHYL]-5-HYDROXY-6-METHYL-PYRIDIN-3-YLMETHYL} ESTER
Definition date:	2007-05-16
Last modified:	2024-09-27
Identifier:	(4-{[(4-aminobutyl)amino]methyl}-5-hydroxy-6-methylpyridin-3-yl)methyl dihydrogen phosphate

AIO

AIO
Name:	[(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN-2-YL]BORONIC ACID
Formula:	C13 H26 B N3 O4
SMILES:	O=C(N1CCCC1B(O)O)C(NC(=O)C(N)C)C(C)CC
InChi:	InChI=1S/C13H26BN3O4/c1-4-8(2)11(16-12(18)9(3)15)13(19)17-7-5-6-10(17)14(20)21/h8-11,20-21H,4-7,15H2,1-3H3,(H,16,18)/t8-,9-,10-,11-/m0/s1
Definition date:	2007-02-23
Last modified:	2024-09-27
Identifier:	[(2R)-1-(L-alanyl-L-isoleucyl)pyrrolidin-2-yl]boronic acid

AIR

AIR
Name:	5-AMINOIMIDAZOLE RIBONUCLEOTIDE
Formula:	C8 H14 N3 O7 P
SMILES:	O=P(O)(O)OCC2OC(n1cncc1N)C(O)C2O
InChi:	InChI=1S/C8H14N3O7P/c9-5-1-10-3-11(5)8-7(13)6(12)4(18-8)2-17-19(14,15)16/h1,3-4,6-8,12-13H,2,9H2,(H2,14,15,16)/t4-,6-,7-,8-/m1/s1
Definition date:	1999-10-21
Last modified:	2024-09-27
Identifier:	1-(5-O-phosphono-beta-D-ribofuranosyl)-1H-imidazol-5-amine

AIX

AIX
Name:	(2R,4S)-2-[(1R)-1-{[(2R)-2-amino-2-phenylacetyl]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
Formula:	C16 H21 N3 O4 S
SMILES:	O=C(NC(C=O)C1SC(C(N1)C(=O)O)(C)C)C(c2ccccc2)N
InChi:	InChI=1S/C16H21N3O4S/c1-16(2)12(15(22)23)19-14(24-16)10(8-20)18-13(21)11(17)9-6-4-3-5-7-9/h3-8,10-12,14,19H,17H2,1-2H3,(H,18,21)(H,22,23)/t10-,11-,12+,14-/m1/s1
Synonyms:	AMPICILLIN (open form)
Definition date:	2009-07-02
Last modified:	2024-09-27
Identifier:	(2R,4S)-2-[(1R)-1-{[(2R)-2-amino-2-phenylacetyl]amino}-2-oxoethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid

P4E

P4E
Name:	(2S,4E)-2-amino-5-phenylpent-4-enoic acid
Formula:	C11 H13 N O2
SMILES:	O=C(O)C(N)C/C=C/c1ccccc1
InChi:	InChI=1S/C11H13NO2/c12-10(11(13)14)8-4-7-9-5-2-1-3-6-9/h1-7,10H,8,12H2,(H,13,14)/b7-4+/t10-/m0/s1
Definition date:	2011-10-13
Last modified:	2024-09-27
Identifier:	(2S,4E)-2-amino-5-phenylpent-4-enoic acid

AJ3

AJ3
Name:	3-(PROP-2-ENE-1-SULFINYL)-PROPENE-1-THIOL
Formula:	C6 H10 O S2
SMILES:	O=S(CC=C)CC=CS
InChi:	InChI=1S/C6H10OS2/c1-2-5-9(7)6-3-4-8/h2-4,8H,1,5-6H2/b4-3+/t9-/m1/s1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	(1E)-3-[(R)-prop-2-en-1-ylsulfinyl]prop-1-ene-1-thiol

AJE

AJE
Name:	(3S,4R)-4-amino-1-(3-carboxypropanoyl)pyrrolidine-3-carboxylic acid
Formula:	C9 H14 N2 O5
SMILES:	O=C(N1CC(C(=O)O)C(N)C1)CCC(=O)O
InChi:	InChI=1S/C9H14N2O5/c10-6-4-11(3-5(6)9(15)16)7(12)1-2-8(13)14/h5-6H,1-4,10H2,(H,13,14)(H,15,16)/t5-,6-/m0/s1
Definition date:	2015-02-04
Last modified:	2024-09-27
Release date:	2015-09-09
Identifier:	(3S,4R)-4-amino-1-(3-carboxypropanoyl)pyrrolidine-3-carboxylic acid

AJF

AJF
Name:	methyl (2S)-2-[(3-ethanoylphenyl)carbonylamino]-3-phenyl-propanoate
Formula:	C19 H19 N O4
SMILES:	COC(=O)[CH](Cc1ccccc1)NC(=O)c2cccc(c2)C(C)=O
InChi:	InChI=1S/C19H19NO4/c1-13(21)15-9-6-10-16(12-15)18(22)20-17(19(23)24-2)11-14-7-4-3-5-8-14/h3-10,12,17H,11H2,1-2H3,(H,20,22)/t17-/m0/s1
Definition date:	2023-05-16
Last modified:	2024-09-27
Release date:	2024-05-15
Identifier:	methyl (2~{S})-2-[(3-ethanoylphenyl)carbonylamino]-3-phenyl-propanoate

P5F

P5F
Name:	N-propargylglycine-modified flavin adenine dinucleotide
Formula:	C32 H40 N10 O17 P2
SMILES:	Cc1cc2c(cc1C)n(C=CC=NCC(O)=O)c3C(=O)NC(=O)Nc3n2C[CH](O)[CH](O)[CH](O)CO[P](O)(=O)O[P](O)(=O)OC[CH]4O[CH]([CH](O)[CH]4O)n5cnc6c(N)ncnc56
InChi:	InChI=1S/C32H40N10O17P2/c1-14-6-16-17(7-15(14)2)41(29-23(30(50)39-32(51)38-29)40(16)5-3-4-34-8-21(45)46)9-18(43)24(47)19(44)10-56-60(52,53)59-61(54,55)57-11-20-25(48)26(49)31(58-20)42-13-37-22-27(33)35-12-36-28(22)42/h3-7,12-13,18-20,24-26,31,43-44,47-49H,8-11H2,1-2H3,(H,45,46)(H,52,53)(H,54,55)(H2,33,35,36)(H2,38,39,50,51)/b5-3+,34-4?/t18-,19+,20+,24-,25+,26+,31+/m0/s1
Definition date:	2013-11-25
Last modified:	2024-09-27
Release date:	2014-02-19
Identifier:	2-[3-[10-[(2S,3S,4R)-5-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]oxy-oxidanyl-phosphoryl]oxy-2,3,4-tris(oxidanyl)pentyl]-7,8-dimethyl-2,4-bis(oxidanylidene)-1H-benzo[g]pteridin-5-yl]prop-2-enylideneamino]ethanoic acid

P5N

P5N
Name:	1-(4-methylphenyl)imidazole
Formula:	C10 H8 N2 O
SMILES:	O=Cc1ccc(cc1)n2ccnc2
InChi:	InChI=1S/C10H8N2O/c13-7-9-1-3-10(4-2-9)12-6-5-11-8-12/h1-8H
Definition date:	2020-04-15
Last modified:	2024-09-27
Release date:	2020-09-23
Identifier:	4-imidazol-1-ylbenzaldehyde

P5P

P5P
Name:	PURINE RIBOSIDE-5'-MONOPHOSPHATE
Formula:	C10 H13 N4 O7 P
SMILES:	O=P(O)(O)OCC3OC(n2cnc1cncnc12)C(O)C3O
InChi:	InChI=1S/C10H13N4O7P/c15-7-6(2-20-22(17,18)19)21-10(8(7)16)14-4-13-5-1-11-3-12-9(5)14/h1,3-4,6-8,10,15-16H,2H2,(H2,17,18,19)/t6-,7-,8-,10-/m1/s1
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	9-(5-O-phosphono-beta-D-ribofuranosyl)-9H-purine

AKG

AKG
Name:	2-OXOGLUTARIC ACID
Formula:	C5 H6 O5
SMILES:	O=C(O)C(=O)CCC(=O)O
InChi:	InChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)
Definition date:	1999-07-08
Last modified:	2024-09-27
Identifier:	2-oxopentanedioic acid

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

238895

數據於2025-07-16公開中

PDB statistics

PDBj update info

Contact PDBj

numon