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DMT

DMT
Name:	3-HYDROXY-4,4-DIMETHYL-2-(METHYLAMINO)-6-OCTENOIC ACID
Formula:	C11 H21 N O3
SMILES:	O=C(O)C(NC)C(O)C(C/C=C/C)(C)C
InChi:	InChI=1S/C11H21NO3/c1-5-6-7-11(2,3)9(13)8(12-4)10(14)15/h5-6,8-9,12-13H,7H2,1-4H3,(H,14,15)/b6-5+/t8-,9-/m0/s1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	4-[(2E)-but-2-en-1-yl]-2,4,5-trideoxy-4-methyl-2-(methylamino)-D-arabinonic acid

DNW

DNW
Name:	3-[(2,4-dinitrophenyl)amino]-L-alanine
Formula:	C9 H10 N4 O6
SMILES:	O=C(O)C(N)CNc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O
InChi:	InChI=1S/C9H10N4O6/c10-6(9(14)15)4-11-7-2-1-5(12(16)17)3-8(7)13(18)19/h1-3,6,11H,4,10H2,(H,14,15)/t6-/m0/s1
Definition date:	2013-05-07
Last modified:	2023-11-03
Release date:	2014-03-12
Identifier:	3-[(2,4-dinitrophenyl)amino]-L-alanine

DOA

DOA
Name:	12-AMINO-DODECANOIC ACID
Formula:	C12 H25 N O2
SMILES:	O=C(O)CCCCCCCCCCCN
InChi:	InChI=1S/C12H25NO2/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h1-11,13H2,(H,14,15)
Definition date:	2000-03-31
Last modified:	2023-11-03
Identifier:	12-aminododecanoic acid

DPQ

DPQ
Name:	(S)-2-AMINO-3-(4-HYDROXY-3-OXOCYCLOHEXA-1,4-DIENYL)PROPANOIC ACID
Formula:	C9 H11 N O4
SMILES:	O=C1C=C(CC(C(=O)O)N)CC=C1O
InChi:	InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h2,4,6,11H,1,3,10H2,(H,13,14)/t6-/m0/s1
Definition date:	2007-05-11
Last modified:	2023-11-03
Identifier:	3-(4-hydroxy-3-oxocyclohexa-1,4-dien-1-yl)-L-alanine

DQK

DQK
Name:	(2~{S})-4-[[(5~{S})-5-azanyl-6-oxidanylidene-hexyl]amino]-2-naphthalen-2-ylsulfanyl-4-oxidanylidene-butanoic acid
Formula:	C20 H24 N2 O4 S
SMILES:	N[CH](CCCCNC(=O)C[CH](Sc1ccc2ccccc2c1)C(O)=O)C=O
InChi:	InChI=1S/C20H24N2O4S/c21-16(13-23)7-3-4-10-22-19(24)12-18(20(25)26)27-17-9-8-14-5-1-2-6-15(14)11-17/h1-2,5-6,8-9,11,13,16,18H,3-4,7,10,12,21H2,(H,22,24)(H,25,26)/t16-,18-/m0/s1
Definition date:	2018-01-26
Last modified:	2023-11-03
Release date:	2018-04-18
Identifier:	(2~{S})-4-[[(5~{S})-5-azanyl-6-oxidanylidene-hexyl]amino]-2-naphthalen-2-ylsulfanyl-4-oxidanylidene-butanoic acid

DTR

DTR
Name:	D-TRYPTOPHAN
Formula:	C11 H12 N2 O2
SMILES:	O=C(O)C(N)Cc2c1ccccc1nc2
InChi:	InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m1/s1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	D-tryptophan

DV9

DV9
Name:	(2S)-2-azanyl-6,6-bis(fluoranyl)-5-oxidanylidene-6-phosphono-hexanoic acid
Formula:	C6 H10 F2 N O6 P
SMILES:	N[CH](CCC(=O)C(F)(F)[P](O)(O)=O)C(O)=O
InChi:	InChI=1S/C6H10F2NO6P/c7-6(8,16(13,14)15)4(10)2-1-3(9)5(11)12/h3H,1-2,9H2,(H,11,12)(H2,13,14,15)/t3-/m0/s1
Definition date:	2019-09-06
Last modified:	2023-11-03
Release date:	2021-09-08
Identifier:	(2~{S})-2-azanyl-6,6-bis(fluoranyl)-5-oxidanylidene-6-phosphono-hexanoic acid

GIC

GIC
Name:	N-(2-aminoethyl)-N-(1H-indol-3-ylacetyl)glycine
Formula:	C14 H17 N3 O3
SMILES:	O=C(O)CN(C(=O)Cc2c1ccccc1nc2)CCN
InChi:	InChI=1S/C14H17N3O3/c15-5-6-17(9-14(19)20)13(18)7-10-8-16-12-4-2-1-3-11(10)12/h1-4,8,16H,5-7,9,15H2,(H,19,20)
Definition date:	2010-10-14
Last modified:	2023-11-03
Identifier:	N-(2-aminoethyl)-N-(1H-indol-3-ylacetyl)glycine

GMO

GMO
Name:	{(4Z)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-[(4-nitrophenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid
Formula:	C15 H16 N4 O6
SMILES:	NC(C2=NC(=[C@H]c1ccc(cc1)[N+]([O-])=O)C(N2CC(O)=O)=O)C(O)C
InChi:	InChI=1S/C15H16N4O6/c1-8(20)13(16)14-17-11(15(23)18(14)7-12(21)22)6-9-2-4-10(5-3-9)19(24)25/h2-6,8,13,20H,7,16H2,1H3,(H,21,22)/b11-6-/t8-,13+/m1/s1
Synonyms:	PEPTIDE DERIVED CHROMOPHORE
Definition date:	2017-10-13
Last modified:	2023-11-03
Release date:	2018-10-17
Identifier:	{(4Z)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-4-[(4-nitrophenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}acetic acid

GPN

GPN
Name:	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-GUANINE
Formula:	C11 H16 N7 O4
SMILES:	O=C(O)CN(C(=O)Cn1c2N=C(NC(=O)c2nc1)N)CC[NH3+]
InChi:	InChI=1S/C11H15N7O4/c12-1-2-17(4-7(20)21)6(19)3-18-5-14-8-9(18)15-11(13)16-10(8)22/h5H,1-4,12H2,(H,20,21)(H3,13,15,16,22)/p+1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	2-{[(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)acetyl](carboxymethyl)amino}ethanaminium

8MC

8MC
Name:	(7-methoxy-2-oxo-2H-chromen-4-yl)acetic acid
Formula:	C12 H10 O5
SMILES:	O=C(O)CC=1c2c(OC(=O)C=1)cc(OC)cc2
InChi:	InChI=1S/C12H10O5/c1-16-8-2-3-9-7(4-11(13)14)5-12(15)17-10(9)6-8/h2-3,5-6H,4H2,1H3,(H,13,14)
Definition date:	2013-05-07
Last modified:	2023-11-03
Release date:	2014-03-12
Identifier:	(7-methoxy-2-oxo-2H-chromen-4-yl)acetic acid

GSE

GSE
Name:	L-ALPHA-GLYCEROPHOSPHORYLSERINE
Formula:	C6 H14 N O8 P
SMILES:	O=C(O)C(N)COP(=O)(OCC(O)CO)O
InChi:	InChI=1S/C6H14NO8P/c7-5(6(10)11)3-15-16(12,13)14-2-4(9)1-8/h4-5,8-9H,1-3,7H2,(H,10,11)(H,12,13)/t4-,5+/m1/s1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	O-[(R)-{[(2R)-2,3-dihydroxypropyl]oxy}(hydroxy)phosphoryl]-L-serine

GYC

GYC
Name:	[(4Z)-2-[(1R)-1-AMINO-2-MERCAPTOETHYL]-4-(4-HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-1-YL]ACETIC ACID
Formula:	C14 H15 N3 O4 S
SMILES:	O=C1C(N=C(N1CC(=O)O)C(N)CS)=Cc2ccc(O)cc2
InChi:	InChI=1S/C14H15N3O4S/c15-10(7-22)13-16-11(14(21)17(13)6-12(19)20)5-8-1-3-9(18)4-2-8/h1-5,10,18,22H,6-7,15H2,(H,19,20)/b11-5-/t10-/m0/s1
Synonyms:	CHROMOPHORE (CYS-TYR-GLY)
Definition date:	2006-05-30
Last modified:	2023-11-03
Identifier:	[(4Z)-2-[(1R)-1-amino-2-sulfanylethyl]-4-(4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl]acetic acid

GYS

GYS
Name:	[(4Z)-2-(1-AMINO-2-HYDROXYETHYL)-4-(4-HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-1-YL]ACETIC ACID
Formula:	C14 H15 N3 O5
SMILES:	O=C1C(N=C(N1CC(=O)O)C(N)CO)=Cc2ccc(O)cc2
InChi:	InChI=1S/C14H15N3O5/c15-10(7-18)13-16-11(14(22)17(13)6-12(20)21)5-8-1-3-9(19)4-2-8/h1-5,10,18-19H,6-7,15H2,(H,20,21)/b11-5-/t10-/m0/s1
Synonyms:	CHROMOPHORE (SER-TYR-GLY)
Definition date:	2006-05-30
Last modified:	2023-11-03
Identifier:	[(4Z)-2-[(1R)-1-amino-2-hydroxyethyl]-4-(4-hydroxybenzylidene)-5-oxo-4,5-dihydro-1H-imidazol-1-yl]acetic 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:	2023-11-03
Release date:	2022-06-29
Identifier:	4-[(4-phenoxyphenyl)sulfonylamino]butanoic acid

H3I

H3I
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-(7~{H}-purin-6-ylcarbamoyl)amino]-2-azanyl-butanoic acid
Formula:	C20 H24 N12 O6
SMILES:	N[CH](CCN(C[CH]1O[CH]([CH](O)[CH]1O)n2cnc3c(N)ncnc23)C(=O)Nc4ncnc5nc[nH]c45)C(O)=O
InChi:	InChI=1S/C20H24N12O6/c21-8(19(35)36)1-2-31(20(37)30-16-11-15(25-4-23-11)26-6-27-16)3-9-12(33)13(34)18(38-9)32-7-29-10-14(22)24-5-28-17(10)32/h4-9,12-13,18,33-34H,1-3,21H2,(H,35,36)(H2,22,24,28)(H2,23,25,26,27,30,37)/t8-,9+,12-,13?,18+/m0/s1
Definition date:	2023-07-21
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-(7~{H}-purin-6-ylcarbamoyl)amino]-2-azanyl-butanoic acid

AFC

AFC
Name:	(3R,12R)-3-amino-12-methyltetradecanoic acid
Formula:	C15 H31 N O2
SMILES:	O=C(O)CC(N)CCCCCCCCC(C)CC
InChi:	InChI=1S/C15H31NO2/c1-3-13(2)10-8-6-4-5-7-9-11-14(16)12-15(17)18/h13-14H,3-12,16H2,1-2H3,(H,17,18)/t13-,14-/m1/s1
Definition date:	2006-09-27
Last modified:	2023-11-03
Identifier:	(3R,12R)-3-amino-12-methyltetradecanoic acid

AGD

AGD
Name:	3-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-D-alanine
Formula:	C8 H10 N6 O3
SMILES:	O=C(O)C(N)Cn1c2N=C(NC(=O)c2nc1)N
InChi:	InChI=1S/C8H10N6O3/c9-3(7(16)17)1-14-2-11-4-5(14)12-8(10)13-6(4)15/h2-3H,1,9H2,(H,16,17)(H3,10,12,13,15)/t3-/m1/s1
Definition date:	2008-02-12
Last modified:	2023-11-03
Identifier:	3-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-D-alanine

AGQ

AGQ
Name:	3-[(3E)-3-(carbamimidoylhydrazono)-4-hydroxy-6-oxocyclohexa-1,4-dien-1-yl]-L-alanine
Formula:	C10 H13 N5 O4
SMILES:	O=C1C=C(O)/C(=N/NC(=[N@H])N)C=C1CC(C(=O)O)N
InChi:	InChI=1S/C10H13N5O4/c11-5(9(18)19)1-4-2-6(14-15-10(12)13)8(17)3-7(4)16/h2-3,5,17H,1,11H2,(H,18,19)(H4,12,13,15)/b14-6+/t5-/m0/s1
Definition date:	2010-05-17
Last modified:	2023-11-03
Identifier:	3-[(3E)-3-(2-carbamimidoylhydrazinylidene)-4-hydroxy-6-oxocyclohexa-1,4-dien-1-yl]-L-alanine

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:	2023-11-03
Release date:	2015-09-09
Identifier:	(3S,4R)-4-amino-1-(3-carboxypropanoyl)pyrrolidine-3-carboxylic acid

APN

APN
Name:	2-AMINOETHYLGLYCINE-CARBONYLMETHYLENE-ADENINE
Formula:	C11 H16 N7 O3
SMILES:	O=C(O)CN(C(=O)Cn1c2ncnc(c2nc1)N)CC[NH3+]
InChi:	InChI=1S/C11H15N7O3/c12-1-2-17(4-8(20)21)7(19)3-18-6-16-9-10(13)14-5-15-11(9)18/h5-6H,1-4,12H2,(H,20,21)(H2,13,14,15)/p+1
Definition date:	1999-07-08
Last modified:	2023-11-03
Identifier:	2-{[(6-amino-9H-purin-9-yl)acetyl](carboxymethyl)amino}ethanaminium

AR0

AR0
Name:	4-amino-1-{[amino(iminio)methyl]amino}-6-[4-(carboxymethyl)pyridinium-1-yl]-1,2,3,4,6-pentadeoxy-D-erythro-hexitol
Formula:	C14 H25 N5 O3
SMILES:	O=C(O)Cc1cc[n+](cc1)CC(O)C(N)CCCNC(=[NH2+])N
InChi:	InChI=1S/C14H23N5O3/c15-11(2-1-5-18-14(16)17)12(20)9-19-6-3-10(4-7-19)8-13(21)22/h3-4,6-7,11-12,20H,1-2,5,8-9,15H2,(H4-,16,17,18,21,22)/p+2/t11-,12+/m0/s1
Definition date:	2010-09-17
Last modified:	2023-11-03
Identifier:	4-amino-1-{[amino(iminio)methyl]amino}-6-[4-(carboxymethyl)pyridinium-1-yl]-1,2,3,4,6-pentadeoxy-D-erythro-hexitol

H9D

H9D
Name:	(2~{R},3~{R},4~{S},5~{R})-2-(6-aminopurin-9-yl)-5-[[2-[[9-[(2~{R},3~{R},4~{S},5~{S})-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-6-yl]amino]ethylamino]methyl]oxolane-3,4-diol
Formula:	C22 H29 N11 O7
SMILES:	Nc1ncnc2n(cnc12)[CH]3O[CH](CNCCNc4ncnc5n(cnc45)[CH]6O[CH](CO)[CH](O)[CH]6O)[CH](O)[CH]3O
InChi:	InChI=1S/C22H29N11O7/c23-17-11-19(28-5-26-17)32(7-30-11)21-15(37)13(35)9(39-21)3-24-1-2-25-18-12-20(29-6-27-18)33(8-31-12)22-16(38)14(36)10(4-34)40-22/h5-10,13-16,21-22,24,34-38H,1-4H2,(H2,23,26,28)(H,25,27,29)
Definition date:	2023-07-21
Last modified:	2023-11-03
Release date:	2023-11-08
Identifier:	(2~{R},3~{R},4~{S},5~{R})-2-(6-aminopurin-9-yl)-5-[[2-[[9-[(2~{R},3~{R},4~{S},5~{S})-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]purin-6-yl]amino]ethylamino]methyl]oxolane-3,4-diol

HAO

HAO
Name:	{[3-(hydrazinocarbonyl)-4-methoxyphenyl]amino}(oxo)acetic acid
Formula:	C10 H11 N3 O5
SMILES:	O=C(O)C(=O)Nc1ccc(OC)c(C(=O)NN)c1
InChi:	InChI=1S/C10H11N3O5/c1-18-7-3-2-5(12-9(15)10(16)17)4-6(7)8(14)13-11/h2-4H,11H2,1H3,(H,12,15)(H,13,14)(H,16,17)
Definition date:	2010-07-01
Last modified:	2023-11-03
Identifier:	{[3-(hydrazinylcarbonyl)-4-methoxyphenyl]amino}(oxo)acetic acid

HCL

HCL
Name:	(2S)-2-azanyl-2-[2-chloranyl-3,5-bis(oxidanyl)phenyl]ethanoic acid
Formula:	C8 H8 Cl N O4
SMILES:	N[CH](C(O)=O)c1cc(O)cc(O)c1Cl
InChi:	InChI=1S/C8H8ClNO4/c9-6-4(7(10)8(13)14)1-3(11)2-5(6)12/h1-2,7,11-12H,10H2,(H,13,14)/t7-/m0/s1
Definition date:	2012-03-05
Last modified:	2023-11-03
Identifier:	(2S)-2-azanyl-2-[2-chloranyl-3,5-bis(oxidanyl)phenyl]ethanoic acid

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