Chemie Search results for query - 일본 단백질구조 데이터 뱅크

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: 2013 results BIRD

KJ2

KJ2
Name:	4-{4-[4-(3-AMINOPROPOXY)PHENYL]-1H-PYRAZOL-5-YL}-6-CHLOROBENZENE-1,3-DIOL
Formula:	C18 H18 Cl N3 O3
SMILES:	Clc3c(O)cc(O)c(c1c(cnn1)c2ccc(OCCCN)cc2)c3
InChi:	InChI=1S/C18H18ClN3O3/c19-15-8-13(16(23)9-17(15)24)18-14(10-21-22-18)11-2-4-12(5-3-11)25-7-1-6-20/h2-5,8-10,23-24H,1,6-7,20H2,(H,21,22)
Definition date:	2005-05-04
Last modified:	2011-06-04
Identifier:	4-{4-[4-(3-aminopropoxy)phenyl]-1H-pyrazol-5-yl}-6-chlorobenzene-1,3-diol

MB1

MB1
Name:	2-chloro-5-nitrobenzenesulfonamide
Formula:	C6 H5 Cl N2 O4 S
SMILES:	O=S(=O)(c1cc(ccc1Cl)[N+]([O-])=O)N
InChi:	InChI=1S/C6H5ClN2O4S/c7-5-2-1-4(9(10)11)3-6(5)14(8,12)13/h1-3H,(H2,8,12,13)
Definition date:	2007-09-04
Last modified:	2011-06-04
Identifier:	2-chloro-5-nitrobenzenesulfonamide

MBN

MBN
Name:	TOLUENE
Formula:	C7 H8
SMILES:	c1ccccc1C
InChi:	InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	methylbenzene

MCA

MCA
Name:	METHYLMALONYL-COENZYME A
Formula:	C25 H40 N7 O19 P3 S
SMILES:	O=C(O)C(C(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(=O)(O)OP(=O)(O)OCC3OC(n2cnc1c(ncnc12)N)C(O)C3OP(=O)(O)O)C
InChi:	InChI=1S/C25H40N7O19P3S/c1-12(23(37)38)24(39)55-7-6-27-14(33)4-5-28-21(36)18(35)25(2,3)9-48-54(45,46)51-53(43,44)47-8-13-17(50-52(40,41)42)16(34)22(49-13)32-11-31-15-19(26)29-10-30-20(15)32/h10-13,16-18,22,34-35H,4-9H2,1-3H3,(H,27,33)(H,28,36)(H,37,38)(H,43,44)(H,45,46)(H2,26,29,30)(H2,40,41,42)/t12-,13-,16-,17-,18+,22-/m1/s1
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	(3S,5R,9R,20R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8,20-trimethyl-10,14,19-trioxo-2,4,6-trioxa-18-thia-11,15-diaza-3,5-diphosphahenicosan-21-oic acid 3,5-dioxide (non-preferred name)

MHB

MHB
Name:	2-((3'-METHYL-4'-HYDROXYPHENYL)AZO)BENZOIC ACID
Formula:	C14 H12 N2 O3
SMILES:	O=C(O)c2ccccc2/N=N/c1ccc(O)c(c1)C
InChi:	InChI=1S/C14H12N2O3/c1-9-8-10(6-7-13(9)17)15-16-12-5-3-2-4-11(12)14(18)19/h2-8,17H,1H3,(H,18,19)/b16-15+
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	2-[(E)-(4-hydroxy-3-methylphenyl)diazenyl]benzoic acid

AYX

AYX
Name:	4-{[(3-nitrophenyl)carbamoyl]amino}benzenesulfonamide
Formula:	C13 H12 N4 O5 S
SMILES:	O=S(=O)(N)c2ccc(NC(=O)Nc1cccc([N+]([O-])=O)c1)cc2
InChi:	InChI=1S/C13H12N4O5S/c14-23(21,22)12-6-4-9(5-7-12)15-13(18)16-10-2-1-3-11(8-10)17(19)20/h1-8H,(H2,14,21,22)(H2,15,16,18)
Definition date:	2010-05-26
Last modified:	2011-06-04
Identifier:	4-{[(3-nitrophenyl)carbamoyl]amino}benzenesulfonamide

EYK

EYK
Name:	2-tert-butylbenzene-1,4-diol
Formula:	C10 H14 O2
SMILES:	Oc1ccc(O)cc1C(C)(C)C
InChi:	InChI=1S/C10H14O2/c1-10(2,3)8-6-7(11)4-5-9(8)12/h4-6,11-12H,1-3H3
Definition date:	2008-10-30
Last modified:	2011-06-04
Identifier:	2-tert-butylbenzene-1,4-diol

F2I

F2I
Name:	N'-{(1S,2R)-1-(3,5-DIFLUOROBENZYL)-2-HYDROXY-3-[(3-IODOBENZYL)AMINO]PROPYL}-5-METHYL-N,N-DIPROPYLISOPHTHALAMIDE
Formula:	C32 H38 F2 I N3 O3
SMILES:	Ic1cc(ccc1)CNCC(O)C(NC(=O)c2cc(cc(C(=O)N(CCC)CCC)c2)C)Cc3cc(F)cc(F)c3
InChi:	InChI=1S/C32H38F2IN3O3/c1-4-9-38(10-5-2)32(41)25-12-21(3)11-24(17-25)31(40)37-29(16-23-13-26(33)18-27(34)14-23)30(39)20-36-19-22-7-6-8-28(35)15-22/h6-8,11-15,17-18,29-30,36,39H,4-5,9-10,16,19-20H2,1-3H3,(H,37,40)/t29-,30+/m0/s1
Definition date:	2006-10-17
Last modified:	2011-06-04
Identifier:	N'-{(1S,2R)-1-(3,5-difluorobenzyl)-2-hydroxy-3-[(3-iodobenzyl)amino]propyl}-5-methyl-N,N-dipropylbenzene-1,3-dicarboxamide

F3B

F3B
Name:	1,3,5-trichloro-2,4,6-trifluorobenzene
Formula:	C6 Cl3 F3
SMILES:	Clc1c(F)c(Cl)c(F)c(Cl)c1F
InChi:	InChI=1S/C6Cl3F3/c7-1-4(10)2(8)6(12)3(9)5(1)11
Definition date:	2008-07-16
Last modified:	2011-06-04
Identifier:	1,3,5-trichloro-2,4,6-trifluorobenzene

F5B

F5B
Name:	1,2,3,4,5-pentafluorobenzene
Formula:	C6 H F5
SMILES:	Fc1cc(F)c(F)c(F)c1F
InChi:	InChI=1S/C6HF5/c7-2-1-3(8)5(10)6(11)4(2)9/h1H
Definition date:	2008-07-11
Last modified:	2011-06-04
Identifier:	1,2,3,4,5-pentafluorobenzene

GVF

GVF
Name:	BENZENE-1,2,3,4-TETRAYL TETRAKIS[DIHYDROGEN (PHOSPHATE)]
Formula:	C6 H10 O16 P4
SMILES:	O=P(Oc1c(OP(=O)(O)O)ccc(OP(=O)(O)O)c1OP(=O)(O)O)(O)O
InChi:	InChI=1S/C6H10O16P4/c7-23(8,9)19-3-1-2-4(20-24(10,11)12)6(22-26(16,17)18)5(3)21-25(13,14)15/h1-2H,(H2,7,8,9)(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)
Definition date:	2007-03-12
Last modified:	2011-06-04
Identifier:	benzene-1,2,3,4-tetrayl tetrakis[dihydrogen (phosphate)]

GZC

GZC
Name:	N,N'''-{ethane-1,2-diylbis[nitrilo(E)methylylidene(4-hydroxybenzene-3,1-diyl)]}diguanidine
Formula:	C18 H22 N8 O2
SMILES:	NC(=N)Nc1ccc(O)c(C=NCCN=Cc2cc(NC(N)=N)ccc2O)c1
InChi:	InChI=1S/C18H22N8O2/c19-17(20)25-13-1-3-15(27)11(7-13)9-23-5-6-24-10-12-8-14(26-18(21)22)2-4-16(12)28/h1-4,7-10,27-28H,5-6H2,(H4,19,20,25)(H4,21,22,26)/b23-9+,24-10+
Definition date:	2009-12-03
Last modified:	2011-06-04
Identifier:	1-[3-[(E)-2-[(E)-(5-carbamimidamido-2-hydroxy-phenyl)methylideneamino]ethyliminomethyl]-4-hydroxy-phenyl]guanidine

H06

H06
Name:	(E)-4-((2-nicotinoylhydrazono)methyl)benzimidamide
Formula:	C14 H13 N5 O
SMILES:	O=C(NN=Cc1ccc(C(=[N@H])N)cc1)c2cccnc2
InChi:	InChI=1S/C14H13N5O/c15-13(16)11-5-3-10(4-6-11)8-18-19-14(20)12-2-1-7-17-9-12/h1-9H,(H3,15,16)(H,19,20)/b18-8+
Definition date:	2009-10-13
Last modified:	2011-06-04
Identifier:	4-{(E)-[2-(pyridin-3-ylcarbonyl)hydrazinylidene]methyl}benzenecarboximidamide

HV7

HV7
Name:	1-METHYLAMINE-2-HYDROXY-4-METHOXY-BENZENE
Formula:	C8 H11 N O2
SMILES:	Oc1cc(OC)ccc1CN
InChi:	InChI=1S/C8H11NO2/c1-11-7-3-2-6(5-9)8(10)4-7/h2-4,10H,5,9H2,1H3
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	2-(aminomethyl)-5-methoxyphenol

I15

I15
Name:	5-[(5-fluoro-3-methyl-1H-indazol-4-yl)oxy]benzene-1,3-dicarbonitrile
Formula:	C16 H9 F N4 O
SMILES:	N#Cc3cc(Oc1c(F)ccc2c1c(nn2)C)cc(C#N)c3
InChi:	InChI=1S/C16H9FN4O/c1-9-15-14(21-20-9)3-2-13(17)16(15)22-12-5-10(7-18)4-11(6-12)8-19/h2-6H,1H3,(H,20,21)
Definition date:	2008-09-08
Last modified:	2011-06-04
Identifier:	5-[(5-fluoro-3-methyl-1H-indazol-4-yl)oxy]benzene-1,3-dicarbonitrile

N25

N25
Name:	1,3-BIS-(4-METHOXY-BENZENESULFONYL)-5,5-DIMETHYL-HEXAHYDRO-PYRIMIDINE-2-CARBOXYLIC ACID HYDROXYAMIDE
Formula:	C21 H27 N3 O8 S2
SMILES:	O=S(=O)(c1ccc(OC)cc1)N2C(N(CC(C)(C2)C)S(=O)(=O)c3ccc(OC)cc3)C(=O)NO
InChi:	InChI=1S/C21H27N3O8S2/c1-21(2)13-23(33(27,28)17-9-5-15(31-3)6-10-17)20(19(25)22-26)24(14-21)34(29,30)18-11-7-16(32-4)8-12-18/h5-12,20,26H,13-14H2,1-4H3,(H,22,25)
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	N-hydroxy-1,3-bis[(4-methoxyphenyl)sulfonyl]-5,5-dimethylhexahydropyrimidine-2-carboxamide

N3B

N3B
Name:	N-[(4'-FLUORO-1,1'-BIPHENYL-4-YL)CARBONYL]-3-NITRO-4-{[2-(PHENYLSULFANYL)ETHYL]AMINO}BENZENESULFONAMIDE
Formula:	C27 H22 F N3 O5 S2
SMILES:	Fc1ccc(cc1)c2ccc(cc2)C(=O)NS(=O)(=O)c3ccc(c([N+]([O-])=O)c3)NCCSc4ccccc4
InChi:	InChI=1S/C27H22FN3O5S2/c28-22-12-10-20(11-13-22)19-6-8-21(9-7-19)27(32)30-38(35,36)24-14-15-25(26(18-24)31(33)34)29-16-17-37-23-4-2-1-3-5-23/h1-15,18,29H,16-17H2,(H,30,32)
Definition date:	2005-03-09
Last modified:	2011-06-04
Identifier:	4'-fluoro-N-[(3-nitro-4-{[2-(phenylsulfanyl)ethyl]amino}phenyl)sulfonyl]biphenyl-4-carboxamide

N4B

N4B
Name:	N-BUTYLBENZENE
Formula:	C10 H14
SMILES:	c1ccccc1CCCC
InChi:	InChI=1S/C10H14/c1-2-3-7-10-8-5-4-6-9-10/h4-6,8-9H,2-3,7H2,1H3
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	butylbenzene

N76

N76
Name:	3-(6-CYCLOHEXYLMETHOXY-9H-PURIN-2-YLAMINO)-BENZENESULFONAMIDE
Formula:	C18 H22 N6 O3 S
SMILES:	O=S(=O)(N)c1cccc(c1)Nc3nc2c(ncn2)c(n3)OCC4CCCCC4
InChi:	InChI=1S/C18H22N6O3S/c19-28(25,26)14-8-4-7-13(9-14)22-18-23-16-15(20-11-21-16)17(24-18)27-10-12-5-2-1-3-6-12/h4,7-9,11-12H,1-3,5-6,10H2,(H2,19,25,26)(H2,20,21,22,23,24)
Definition date:	2003-06-26
Last modified:	2011-06-04
Identifier:	3-{[6-(cyclohexylmethoxy)-9H-purin-2-yl]amino}benzenesulfonamide

NAB

NAB
Name:	2-((4'-HYDROXYNAPHTHYL)-AZO)BENZOIC ACID
Formula:	C17 H12 N2 O3
SMILES:	O=C(O)c3ccccc3/N=N/c2c1ccccc1c(O)cc2
InChi:	InChI=1S/C17H12N2O3/c20-16-10-9-15(11-5-1-2-6-12(11)16)19-18-14-8-4-3-7-13(14)17(21)22/h1-10,20H,(H,21,22)/b19-18+
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	2-[(E)-(4-hydroxynaphthalen-1-yl)diazenyl]benzoic acid

NAF

NAF
Name:	M-(N,N,N-TRIMETHYLAMMONIO)-2,2,2-TRIFLUORO-1,1-DIHYDROXYETHYLBENZENE
Formula:	C11 H15 F3 N O2
SMILES:	FC(F)(F)C(O)(O)c1cc(ccc1)[N+](C)(C)C
InChi:	InChI=1S/C11H15F3NO2/c1-15(2,3)9-6-4-5-8(7-9)10(16,17)11(12,13)14/h4-7,16-17H,1-3H3/q+1
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	N,N,N-trimethyl-3-(2,2,2-trifluoro-1,1-dihydroxyethyl)anilinium

NBB

NBB
Name:	N-BUTYL-BENZENESULFONAMIDE
Formula:	C10 H15 N O2 S
SMILES:	O=S(=O)(NCCCC)c1ccccc1
InChi:	InChI=1S/C10H15NO2S/c1-2-3-9-11-14(12,13)10-7-5-4-6-8-10/h4-8,11H,2-3,9H2,1H3
Definition date:	2003-10-14
Last modified:	2011-06-04
Identifier:	N-butylbenzenesulfonamide

NBE

NBE
Name:	NITROSOBENZENE
Formula:	C6 H5 N O
SMILES:	O=Nc1ccccc1
InChi:	InChI=1S/C6H5NO/c8-7-6-4-2-1-3-5-6/h1-5H
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	nitrosobenzene

NBZ

NBZ
Name:	NITROBENZENE
Formula:	C6 H5 N O2
SMILES:	[O-][N+](=O)c1ccccc1
InChi:	InChI=1S/C6H5NO2/c8-7(9)6-4-2-1-3-5-6/h1-5H
Definition date:	1999-07-08
Last modified:	2011-06-04
Identifier:	nitrobenzene

4MD

4MD
Name:	N-(4-chlorobenzyl)-N-methylbenzene-1,4-disulfonamide
Formula:	C14 H15 Cl N2 O4 S2
SMILES:	Clc1ccc(cc1)CN(C)S(=O)(=O)c2ccc(cc2)S(=O)(=O)N
InChi:	InChI=1S/C14H15ClN2O4S2/c1-17(10-11-2-4-12(15)5-3-11)23(20,21)14-8-6-13(7-9-14)22(16,18)19/h2-9H,10H2,1H3,(H2,16,18,19)
Definition date:	2008-06-03
Last modified:	2011-06-04
Identifier:	N-(4-chlorobenzyl)-N-methylbenzene-1,4-disulfonamide

<66 67 68 69 70 71 72 73 747576 77 78 79 80 81 >

222415

건을2024-07-10부터공개중

PDB statistics

PDBj update info

Contact PDBj

numon