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: 35755 results BIRD

XEQ

XEQ
Name:	(3~{S},11~{b}~{R})-9,10-dimethoxy-3-(2-methylpropyl)-1,3,4,6,7,11~{b}-hexahydrobenzo[a]quinolizin-2-one
Formula:	C19 H27 N O3
SMILES:	COc1cc2CCN3C[CH](CC(C)C)C(=O)C[CH]3c2cc1OC
InChi:	InChI=1S/C19H27NO3/c1-12(2)7-14-11-20-6-5-13-8-18(22-3)19(23-4)9-15(13)16(20)10-17(14)21/h8-9,12,14,16H,5-7,10-11H2,1-4H3/t14-,16+/m0/s1
Definition date:	2023-10-31
Last modified:	2024-09-20
Release date:	2024-09-25
Identifier:	(3~{S},11~{b}~{R})-9,10-dimethoxy-3-(2-methylpropyl)-1,3,4,6,7,11~{b}-hexahydrobenzo[a]quinolizin-2-one

W9H

W9H
Name:	2-benzyl-4-phenyl-1,3-thiazole-5-carboxylic acid
Formula:	C17 H13 N O2 S
SMILES:	O=C(O)c1sc(Cc2ccccc2)nc1c1ccccc1
InChi:	InChI=1S/C17H13NO2S/c19-17(20)16-15(13-9-5-2-6-10-13)18-14(21-16)11-12-7-3-1-4-8-12/h1-10H,11H2,(H,19,20)
Definition date:	2023-09-27
Last modified:	2024-09-20
Release date:	2024-09-25
Identifier:	2-benzyl-4-phenyl-1,3-thiazole-5-carboxylic acid

Y9G

Y9G
Name:	8-{[2-(fluorosulfonyl)ethyl]amino}-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Formula:	C12 H11 F N2 O5 S
SMILES:	FS(=O)(=O)CCNc1cccc2c1NC=C(C2=O)C(=O)O
InChi:	InChI=1S/C12H11FN2O5S/c13-21(19,20)5-4-14-9-3-1-2-7-10(9)15-6-8(11(7)16)12(17)18/h1-3,6,14H,4-5H2,(H,15,16)(H,17,18)
Definition date:	2023-11-28
Last modified:	2024-09-20
Release date:	2024-09-25
Identifier:	8-{[2-(fluorosulfonyl)ethyl]amino}-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

YCI

YCI
Name:	8-{4-[(fluorosulfonyl)oxy]phenyl}-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Formula:	C16 H10 F N O6 S
SMILES:	FS(=O)(=O)Oc1ccc(cc1)c1cccc2c1NC=C(C2=O)C(=O)O
InChi:	InChI=1S/C16H10FNO6S/c17-25(22,23)24-10-6-4-9(5-7-10)11-2-1-3-12-14(11)18-8-13(15(12)19)16(20)21/h1-8H,(H,18,19)(H,20,21)
Definition date:	2023-11-30
Last modified:	2024-09-20
Release date:	2024-09-25
Identifier:	8-{4-[(fluorosulfonyl)oxy]phenyl}-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

A1D9K

A1D9K
Name:	~{N}-[(2~{S})-3-[1-[4-(4-cyanophenyl)phenyl]-1,2,3-triazol-4-yl]-1-[(3-oxidanylcyclobutyl)amino]-1-oxidanylidene-propan-2-yl]-1-phenyl-cyclopropane-1-carboxamide
Formula:	C32 H30 N6 O3
SMILES:	O[CH]1C[CH](C1)NC(=O)[CH](Cc2cn(nn2)c3ccc(cc3)c4ccc(cc4)C#N)NC(=O)C5(CC5)c6ccccc6
InChi:	InChI=1S/C32H30N6O3/c33-19-21-6-8-22(9-7-21)23-10-12-27(13-11-23)38-20-26(36-37-38)18-29(30(40)34-25-16-28(39)17-25)35-31(41)32(14-15-32)24-4-2-1-3-5-24/h1-13,20,25,28-29,39H,14-18H2,(H,34,40)(H,35,41)/t25-,28+,29-/m0/s1
Definition date:	2024-07-02
Last modified:	2024-09-20
Release date:	2024-09-25
Identifier:	~{N}-[(2~{S})-3-[1-[4-(4-cyanophenyl)phenyl]-1,2,3-triazol-4-yl]-1-[(3-oxidanylcyclobutyl)amino]-1-oxidanylidene-propan-2-yl]-1-phenyl-cyclopropane-1-carboxamide

A1ADB

A1ADB
Name:	N-{3-[(2-amino-6-methylpyrimidin-4-yl)amino]-5-[(4-methylpiperazin-1-yl)methyl]phenyl}-3-[(quinolin-4-yl)amino]benzamide
Formula:	C33 H35 N9 O
SMILES:	Cc1cc(nc(N)n1)Nc1cc(cc(NC(=O)c2cccc(Nc3ccnc4ccccc43)c2)c1)CN1CCN(C)CC1
InChi:	InChI=1S/C33H35N9O/c1-22-16-31(40-33(34)36-22)38-26-17-23(21-42-14-12-41(2)13-15-42)18-27(20-26)39-32(43)24-6-5-7-25(19-24)37-30-10-11-35-29-9-4-3-8-28(29)30/h3-11,16-20H,12-15,21H2,1-2H3,(H,35,37)(H,39,43)(H3,34,36,38,40)
Definition date:	2024-01-19
Last modified:	2024-09-20
Release date:	2024-09-25
Identifier:	N-{3-[(2-amino-6-methylpyrimidin-4-yl)amino]-5-[(4-methylpiperazin-1-yl)methyl]phenyl}-3-[(quinolin-4-yl)amino]benzamide

A1H2F

A1H2F
Name:	(3~{S})-3-[7-[1-[7-[4-[6-(4-chlorophenyl)-1-methyl-spiro[[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-4,1'-cyclopropane]-8-yl]pyrazol-1-yl]heptyl]piperidin-4-yl]-3-oxidanylidene-1~{H}-isoindol-2-yl]piperidine-2,6-dione
Formula:	C47 H50 Cl N9 O3
SMILES:	Cc1nnc2n1c3ccc(cc3C(=NC24CC4)c5ccc(Cl)cc5)c6cnn(CCCCCCCN7CCC(CC7)c8cccc9C(=O)N(Cc89)[CH]%10CCC(=O)NC%10=O)c6
InChi:	InChI=1S/C47H50ClN9O3/c1-30-52-53-46-47(20-21-47)51-43(32-10-13-35(48)14-11-32)38-26-33(12-15-40(38)57(30)46)34-27-49-55(28-34)23-6-4-2-3-5-22-54-24-18-31(19-25-54)36-8-7-9-37-39(36)29-56(45(37)60)41-16-17-42(58)50-44(41)59/h7-15,26-28,31,41H,2-6,16-25,29H2,1H3,(H,50,58,59)/t41-/m0/s1
Definition date:	2024-01-18
Last modified:	2024-09-20
Release date:	2024-09-25
Identifier:	(3~{S})-3-[7-[1-[7-[4-[6-(4-chlorophenyl)-1-methyl-spiro[[1,2,4]triazolo[4,3-a][1,4]benzodiazepine-4,1'-cyclopropane]-8-yl]pyrazol-1-yl]heptyl]piperidin-4-yl]-3-oxidanylidene-1~{H}-isoindol-2-yl]piperidine-2,6-dione

A1H6L

A1H6L
Name:	8-(azaindolyl)-benzoazepinone
Formula:	C23 H19 N3 O
SMILES:	O=C1Cc2cc(ccc2CCN1c3ccccc3)c4ccnc5[nH]ccc45
InChi:	InChI=1S/C23H19N3O/c27-22-15-18-14-17(20-8-11-24-23-21(20)9-12-25-23)7-6-16(18)10-13-26(22)19-4-2-1-3-5-19/h1-9,11-12,14H,10,13,15H2,(H,24,25)
Synonyms:	3-phenyl-7-(1~{H}-pyrrolo[2,3-b]pyridin-4-yl)-2,5-dihydro-1~{H}-3-benzazepin-4-one
Definition date:	2024-03-20
Last modified:	2024-09-20
Release date:	2024-09-25
Identifier:	3-phenyl-7-(1~{H}-pyrrolo[2,3-b]pyridin-4-yl)-2,5-dihydro-1~{H}-3-benzazepin-4-one

A1IOQ

A1IOQ
Name:	7-(2-chloroethyl)-1,3-dimethyl-purine-2,6-dione
Formula:	C9 H11 Cl N4 O2
SMILES:	CN1C(=O)N(C)c2ncn(CCCl)c2C1=O
InChi:	InChI=1S/C9H11ClN4O2/c1-12-7-6(8(15)13(2)9(12)16)14(4-3-10)5-11-7/h5H,3-4H2,1-2H3
Definition date:	2024-09-16
Last modified:	2024-09-20
Release date:	2024-09-25
Identifier:	7-(2-chloroethyl)-1,3-dimethyl-purine-2,6-dione

9ED

9ED
Name:	[(2R)-2-[(E)-octadec-9-enoyl]oxy-3-[oxidanyl-[(1R,2R,3S,4R,5R,6S)-2,3,6-tris(oxidanyl)-4,5-diphosphonooxy-cyclohexyl]oxy-phosphoryl]oxy-propyl] (E)-octadec-9-enoate
Formula:	C45 H85 O19 P3
SMILES:	CCCCCCCCC=CCCCCCCCC(=O)OC[CH](CO[P](O)(=O)O[CH]1[CH](O)[CH](O)[CH](O[P](O)(O)=O)[CH](O[P](O)(O)=O)[CH]1O)OC(=O)CCCCCCCC=CCCCCCCCC
InChi:	InChI=1S/C45H85O19P3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(46)59-35-37(61-39(47)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)36-60-67(57,58)64-43-40(48)41(49)44(62-65(51,52)53)45(42(43)50)63-66(54,55)56/h17-20,37,40-45,48-50H,3-16,21-36H2,1-2H3,(H,57,58)(H2,51,52,53)(H2,54,55,56)/b19-17+,20-18+/t37-,40-,41+,42+,43-,44-,45-/m1/s1
Synonyms:	PtdIns(4,5)P2
Definition date:	2022-01-14
Last modified:	2024-09-19
Release date:	2024-09-19
Identifier:	[(2~{R})-2-[(~{E})-octadec-9-enoyl]oxy-3-[oxidanyl-[(1~{R},2~{R},3~{S},4~{R},5~{R},6~{S})-2,3,6-tris(oxidanyl)-4,5-diphosphonooxy-cyclohexyl]oxy-phosphoryl]oxy-propyl] (~{E})-octadec-9-enoate

SAO

SAO
Name:	5'-S-[(3S)-3-azaniumyl-3-carboxypropyl]-5'-thioadenosine
Formula:	C14 H21 N6 O5 S
SMILES:	[NH3+]C(C(O)=O)CCSCC1OC(C(C1O)O)n2cnc3c2ncnc3N
InChi:	InChI=1S/C14H20N6O5S/c15-6(14(23)24)1-2-26-3-7-9(21)10(22)13(25-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)/p+1/t6-,7+,9+,10+,13+/m0/s1
Synonyms:	S-ADENOSYL-L-HOMOCYSTEINE
Definition date:	2016-04-08
Last modified:	2024-09-18
Release date:	2017-03-15
Identifier:	5'-S-[(3S)-3-azaniumyl-3-carboxypropyl]-5'-thioadenosine

V5H

V5H
Name:	(2S)-2-[(9,10-dibromooctadecanoyl)oxy]-3-{[(S)-hydroxy{[(1R,2R,3S,4R,5R,6S)-2,3,6-trihydroxy-4,5-bis(phosphonooxy)cyclohexyl]oxy}phosphoryl]oxy}propyl (9R,10S)-9,10-dibromooctadecanoate
Formula:	C45 H85 Br4 O19 P3
SMILES:	OP(=O)(O)OC1C(O)C(O)C(OP(=O)(O)OCC(COC(=O)CCCCCCCC(Br)C(Br)CCCCCCCC)OC(=O)CCCCCCCC(Br)C(Br)CCCCCCCC)C(O)C1OP(=O)(O)O
InChi:	InChI=1S/C45H85Br4O19P3/c1-3-5-7-9-13-19-25-34(46)36(48)27-21-15-11-17-23-29-38(50)63-31-33(65-39(51)30-24-18-12-16-22-28-37(49)35(47)26-20-14-10-8-6-4-2)32-64-71(61,62)68-43-40(52)41(53)44(66-69(55,56)57)45(42(43)54)67-70(58,59)60/h33-37,40-45,52-54H,3-32H2,1-2H3,(H,61,62)(H2,55,56,57)(H2,58,59,60)/t33-,34-,35?,36+,37?,40+,41-,42-,43+,44+,45+/m0/s1
Definition date:	2023-09-08
Last modified:	2024-09-18
Release date:	2024-05-08
Identifier:	(2S)-2-[(9,10-dibromooctadecanoyl)oxy]-3-{[(S)-hydroxy{[(1R,2R,3S,4R,5R,6S)-2,3,6-trihydroxy-4,5-bis(phosphonooxy)cyclohexyl]oxy}phosphoryl]oxy}propyl (9R,10S)-9,10-dibromooctadecanoate

SH9

SH9
Name:	4-ethoxy-1-benzothiophene-2-carboximidamide
Formula:	C11 H12 N2 O S
SMILES:	CCOc1cccc2sc(cc12)C(N)=N
InChi:	InChI=1S/C11H12N2OS/c1-2-14-8-4-3-5-9-7(8)6-10(15-9)11(12)13/h3-6H,2H2,1H3,(H3,12,13)
Definition date:	2022-12-15
Last modified:	2024-09-17
Release date:	2023-08-02
Identifier:	4-ethoxy-1-benzothiophene-2-carboximidamide

SDM

SDM
Name:	4-ethoxy-1-benzothiophene-2-carboximidamide
Formula:	C11 H12 N2 O S
SMILES:	N=C(N)c1cc2c(cccc2s1)OCC
InChi:	InChI=1S/C11H12N2OS/c1-2-14-8-4-3-5-9-7(8)6-10(15-9)11(12)13/h3-6H,2H2,1H3,(H3,12,13)
Definition date:	2022-12-15
Last modified:	2024-09-16
Release date:	2023-08-02
Identifier:	4-ethoxy-1-benzothiophene-2-carboximidamide

Q90

Q90
Name:	4-[4-chloranyl-2-(2-hydroxy-2-oxoethyloxy)phenyl]-2-[(4-phenylphenyl)sulfonylamino]benzoic acid
Formula:	C27 H20 Cl N O7 S
SMILES:	Clc1cc(OCC(=O)O)c(cc1)c1cc(NS(=O)(=O)c2ccc(cc2)c2ccccc2)c(cc1)C(=O)O
InChi:	InChI=1S/C27H20ClNO7S/c28-20-9-13-22(25(15-20)36-16-26(30)31)19-8-12-23(27(32)33)24(14-19)29-37(34,35)21-10-6-18(7-11-21)17-4-2-1-3-5-17/h1-15,29H,16H2,(H,30,31)(H,32,33)
Definition date:	2023-03-28
Last modified:	2024-09-16
Release date:	2024-03-27
Identifier:	(1M)-3-([1,1'-biphenyl]-4-sulfonamido)-2'-(carboxymethoxy)-4'-chloro[1,1'-biphenyl]-4-carboxylic acid

SAH

SAH
Name:	S-ADENOSYL-L-HOMOCYSTEINE
Formula:	C14 H20 N6 O5 S
SMILES:	O=C(O)C(N)CCSCC3OC(n2cnc1c(ncnc12)N)C(O)C3O
InChi:	InChI=1S/C14H20N6O5S/c15-6(14(23)24)1-2-26-3-7-9(21)10(22)13(25-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)/t6-,7+,9+,10+,13+/m0/s1
Definition date:	1999-07-08
Last modified:	2024-09-16
Identifier:	(2S)-2-amino-4-({[(2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl}sulfanyl)butanoic acid (non-preferred name)

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:	C27 H38 N12 O9
SMILES:	O=C(O)C(N)CCN(CC1OC(n2cnc3c(N)ncnc32)C(O)C1O)CCCNc1ncnc2c1ncn2C1OC(CO)C(O)C1O
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:	2024-09-16
Release date:	2023-11-08
Identifier:	(2S)-2-amino-4-({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl}[3-({9-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-6-yl}amino)propyl]amino)butanoic acid (non-preferred name)

IZJ

IZJ
Name:	methyl 3-[[2-chloranyl-6-(methylamino)purin-9-yl]methyl]benzoate
Formula:	C15 H14 Cl N5 O2
SMILES:	O=C(OC)c1cccc(c1)Cn1cnc2c(nc(Cl)nc21)NC
InChi:	InChI=1S/C15H14ClN5O2/c1-17-12-11-13(20-15(16)19-12)21(8-18-11)7-9-4-3-5-10(6-9)14(22)23-2/h3-6,8H,7H2,1-2H3,(H,17,19,20)
Definition date:	2023-08-04
Last modified:	2024-09-16
Release date:	2023-12-06
Identifier:	methyl 3-{[2-chloro-6-(methylamino)-9H-purin-9-yl]methyl}benzoate

JP9

JP9
Name:	(3~{S},4~{S})-2,3,4-tris(oxidanyl)-5-oxidanylidene-6-phosphonooxy-hexane-1-sulfonic acid
Formula:	C6 H13 O11 P S
SMILES:	OC(C(O)CS(=O)(=O)O)C(O)C(=O)COP(=O)(O)O
InChi:	InChI=1S/C6H13O11PS/c7-3(1-17-18(11,12)13)5(9)6(10)4(8)2-19(14,15)16/h4-6,8-10H,1-2H2,(H2,11,12,13)(H,14,15,16)/t4-,5-,6-/m1/s1
Definition date:	2023-08-08
Last modified:	2024-09-16
Release date:	2023-10-25
Identifier:	6-deoxy-1-O-phosphono-6-sulfo-D-fructose

WHC

WHC
Name:	1~{H}-1,3,5-triazine-2,4-dione
Formula:	C3 H3 N3 O2
SMILES:	O=C1NC=NC(=O)N1
InChi:	InChI=1S/C3H3N3O2/c7-2-4-1-5-3(8)6-2/h1H,(H2,4,5,6,7,8)
Synonyms:	5-azauracil
Definition date:	2023-10-03
Last modified:	2024-09-13
Release date:	2024-09-18
Identifier:	1~{H}-1,3,5-triazine-2,4-dione

SD9

SD9
Name:	2-cyano-1-methyl-3-[2-[(5-methyl-1~{H}-imidazol-4-yl)methylsulfanyl]ethyl]guanidine
Formula:	C10 H16 N6 S
SMILES:	CNC(NCCSCc1nc[nH]c1C)=NC#N
InChi:	InChI=1S/C10H16N6S/c1-8-9(16-7-15-8)5-17-4-3-13-10(12-2)14-6-11/h7H,3-5H2,1-2H3,(H,15,16)(H2,12,13,14)
Synonyms:	cimetidine
Definition date:	2023-04-11
Last modified:	2024-09-13
Release date:	2024-09-18
Identifier:	2-cyano-1-methyl-3-[2-[(5-methyl-1~{H}-imidazol-4-yl)methylsulfanyl]ethyl]guanidine

V8I

V8I
Name:	2,4-dichloro-5-sulfamoylbenzoic acid
Formula:	C7 H5 Cl2 N O4 S
SMILES:	N[S](=O)(=O)c1cc(C(O)=O)c(Cl)cc1Cl
InChi:	InChI=1S/C7H5Cl2NO4S/c8-4-2-5(9)6(15(10,13)14)1-3(4)7(11)12/h1-2H,(H,11,12)(H2,10,13,14)
Synonyms:	2,4-bis(chloranyl)-5-sulfamoyl-benzoic acid
Definition date:	2023-09-11
Last modified:	2024-09-13
Release date:	2024-09-18
Identifier:	2,4-bis(chloranyl)-5-sulfamoyl-benzoic acid

X3O

X3O
Name:	2-{bis[5-(trifluoromethyl)pyridin-2-yl]phosphoryl}-2-methyl-N-(2-{[2-(trifluoromethyl)phenyl]sulfanyl}ethyl)propanamide
Formula:	C25 H21 F9 N3 O2 P S
SMILES:	O=P(c1ccc(cn1)C(F)(F)F)(c1ccc(cn1)C(F)(F)F)C(C)(C)C(=O)NCCSc1ccccc1C(F)(F)F
InChi:	InChI=1S/C25H21F9N3O2PS/c1-22(2,21(38)35-11-12-41-18-6-4-3-5-17(18)25(32,33)34)40(39,19-9-7-15(13-36-19)23(26,27)28)20-10-8-16(14-37-20)24(29,30)31/h3-10,13-14H,11-12H2,1-2H3,(H,35,38)
Definition date:	2023-05-31
Last modified:	2024-09-13
Release date:	2024-09-18
Identifier:	2-{bis[5-(trifluoromethyl)pyridin-2-yl]phosphoryl}-2-methyl-N-(2-{[2-(trifluoromethyl)phenyl]sulfanyl}ethyl)propanamide

W6U

W6U
Name:	(2S,4R)-1-[(2S)-3,3-dimethyl-2-[3-[4-[4-[4-[[3-oxidanylidene-1-[6-(2-oxidanylpropan-2-yl)pyridin-2-yl]-2-prop-2-enyl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]phenyl]piperazin-1-yl]butoxy]propanoylamino]butanoyl]-N-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide
Formula:	C55 H70 N12 O7 S
SMILES:	Cc1ncsc1c2ccc(CNC(=O)[CH]3C[CH](O)CN3C(=O)[CH](NC(=O)CCOCCCCN4CCN(CC4)c5ccc(Nc6ncc7C(=O)N(CC=C)N(c8cccc(n8)C(C)(C)O)c7n6)cc5)C(C)(C)C)cc2
InChi:	InChI=1S/C55H70N12O7S/c1-8-23-66-51(71)42-33-57-53(62-49(42)67(66)45-13-11-12-44(60-45)55(6,7)73)59-39-18-20-40(21-19-39)64-27-25-63(26-28-64)24-9-10-29-74-30-22-46(69)61-48(54(3,4)5)52(72)65-34-41(68)31-43(65)50(70)56-32-37-14-16-38(17-15-37)47-36(2)58-35-75-47/h8,11-21,33,35,41,43,48,68,73H,1,9-10,22-32,34H2,2-7H3,(H,56,70)(H,61,69)(H,57,59,62)/t41-,43+,48-/m1/s1
Definition date:	2023-09-21
Last modified:	2024-09-13
Release date:	2024-09-18
Identifier:	(2~{S},4~{R})-1-[(2~{S})-3,3-dimethyl-2-[3-[4-[4-[4-[[3-oxidanylidene-1-[6-(2-oxidanylpropan-2-yl)pyridin-2-yl]-2-prop-2-enyl-pyrazolo[3,4-d]pyrimidin-6-yl]amino]phenyl]piperazin-1-yl]butoxy]propanoylamino]butanoyl]-~{N}-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]-4-oxidanyl-pyrrolidine-2-carboxamide

WTQ

WTQ
Name:	pyridine-2,6-diol
Formula:	C5 H5 N O2
SMILES:	Oc1cccc(O)n1
InChi:	InChI=1S/C5H5NO2/c7-4-2-1-3-5(8)6-4/h1-3H,(H2,6,7,8)
Definition date:	2023-10-12
Last modified:	2024-09-13
Release date:	2024-09-18
Identifier:	pyridine-2,6-diol

<164 165 166 167 168 169 170171172 173 174 175 176 177 178 179 >

227111

건을2024-11-06부터공개중

PDB statistics

PDBj update info

Contact PDBj

numon