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L3W

L3W
Name:	[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{S},4~{R},5~{R})-5-[[(1~{E},3~{Z})-5-azanyl-4-oxidanyl-5-oxidanylidene-penta-1,3-dienyl]-methanoyl-amino]-3,4-bis(oxidanyl)oxolan-2-yl]methyl hydrogen phosphate
Formula:	C21 H29 N7 O16 P2
SMILES:	NC(=O)C(O)=CC=CN(C=O)[CH]1O[CH](CO[P](O)(=O)O[P](O)(=O)OC[CH]2O[CH]([CH](O)[CH]2O)n3cnc4c(N)ncnc34)[CH](O)[CH]1O
InChi:	InChI=1S/C21H29N7O16P2/c22-17-12-19(25-6-24-17)28(7-26-12)21-16(34)14(32)11(43-21)5-41-46(38,39)44-45(36,37)40-4-10-13(31)15(33)20(42-10)27(8-29)3-1-2-9(30)18(23)35/h1-3,6-8,10-11,13-16,20-21,30-34H,4-5H2,(H2,23,35)(H,36,37)(H,38,39)(H2,22,24,25)/b3-1+,9-2-/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1
Definition date:	2019-07-18
Last modified:	2020-07-17
Release date:	2020-07-22
Identifier:	[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{S},4~{R},5~{R})-5-[[(1~{E},3~{Z})-5-azanyl-4-oxidanyl-5-oxidanylidene-penta-1,3-dienyl]-methanoyl-amino]-3,4-bis(oxidanyl)oxolan-2-yl]methyl hydrogen phosphate

L6S

L6S
Name:	6-O-sulfo-alpha-L-galactopyranose
Formula:	C6 H12 O9 S
SMILES:	O=S(=O)(O)OCC1OC(O)C(O)C(O)C1O
InChi:	InChI=1S/C6H12O9S/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H,11,12,13)/t2-,3+,4+,5-,6+/m0/s1
Synonyms:	6-O-sulfo-alpha-L-galactose
Definition date:	2009-08-27
Last modified:	2020-07-17
Identifier:	6-O-sulfo-alpha-L-galactopyranose

JLT

JLT
Name:	3,7-anhydro-1,2,8-trideoxy-1,8-diphosphono-D-glycero-D-gulo-octitol
Formula:	C8 H18 O10 P2
SMILES:	O[CH]1[CH](O)[CH](CC[P](O)(O)=O)O[CH](C[P](O)(O)=O)[CH]1O
InChi:	InChI=1S/C8H18O10P2/c9-6-4(1-2-19(12,13)14)18-5(3-20(15,16)17)7(10)8(6)11/h4-11H,1-3H2,(H2,12,13,14)(H2,15,16,17)/t4-,5+,6-,7+,8+/m0/s1
Synonyms:	[(2~{S},3~{S},4~{R},5~{R},6~{S})-3,4,5-tris(oxidanyl)-6-(2-phosphonoethyl)oxan-2-yl]methylphosphonic acid
Definition date:	2019-03-11
Last modified:	2020-07-17
Release date:	2020-04-01
Identifier:	[(2~{S},3~{S},4~{R},5~{R},6~{S})-3,4,5-tris(oxidanyl)-6-(2-phosphonoethyl)oxan-2-yl]methylphosphonic acid

JRV

JRV
Name:	methyl 6-S-beta-D-glucopyranosyl-6-thio-beta-D-glucopyranoside
Formula:	C13 H24 O10 S
SMILES:	C1(OC(C(O)C(C1O)O)SCC2OC(C(C(C2O)O)O)OC)CO
InChi:	InChI=1S/C13H24O10S/c1-21-12-10(19)8(17)7(16)5(22-12)3-24-13-11(20)9(18)6(15)4(2-14)23-13/h4-20H,2-3H2,1H3/t4-,5-,6-,7-,8+,9+,10-,11-,12-,13+/m1/s1
Synonyms:	METHYL 6-THIO-BETA-GENTIOBIOSIDE
Definition date:	2018-09-19
Last modified:	2020-07-17
Release date:	2019-05-29
Identifier:	methyl 6-S-beta-D-glucopyranosyl-6-thio-beta-D-glucopyranoside

JS2

JS2
Name:	5-O-[(R)-{[(S)-[4-(8-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)butoxy](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-alpha-D- ribofuranose
Formula:	C14 H23 N5 O12 P2
SMILES:	O=C3NC=Nc1c3nc(N)n1CCCCOP(=O)(O)OP(=O)(O)OCC2OC(O)C(O)C2O
InChi:	InChI=1S/C14H23N5O12P2/c15-14-18-8-11(16-6-17-12(8)22)19(14)3-1-2-4-28-32(24,25)31-33(26,27)29-5-7-9(20)10(21)13(23)30-7/h6-7,9-10,13,20-21,23H,1-5H2,(H2,15,18)(H,24,25)(H,26,27)(H,16,17,22)/t7-,9-,10-,13+/m1/s1
Synonyms:	5-O-[(R)-{[(S)-[4-(8-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)butoxy](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-alpha-D- ribose
Definition date:	2014-06-18
Last modified:	2020-07-17
Release date:	2015-05-13
Identifier:	5-O-[(R)-{[(S)-[4-(8-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)butoxy](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-alpha-D- ribofuranose

JSV

JSV
Name:	methyl 2-S-beta-D-glucopyranosyl-2-thio-beta-D-glucopyranoside
Formula:	C13 H24 O10 S
SMILES:	OC1C(OC(C(C1O)O)CO)SC2C(O)C(O)C(OC2OC)CO
InChi:	InChI=1S/C13H24O10S/c1-21-12-11(9(19)7(17)4(2-14)22-12)24-13-10(20)8(18)6(16)5(3-15)23-13/h4-20H,2-3H2,1H3/t4-,5-,6-,7-,8+,9+,10-,11-,12-,13+/m1/s1
Synonyms:	METHYL 2-THIO-BETA-SOPHOROSIDE
Definition date:	2018-09-20
Last modified:	2020-07-17
Release date:	2019-05-29
Identifier:	methyl 2-S-beta-D-glucopyranosyl-2-thio-beta-D-glucopyranoside

JV4

JV4
Name:	6-deoxy-6-fluoro-1-O-phosphono-alpha-D-glucopyranose
Formula:	C6 H12 F O8 P
SMILES:	C1(C(C(OC(C1O)CF)OP(O)(=O)O)O)O
InChi:	InChI=1S/C6H12FO8P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-6,8-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1
Synonyms:	6-deoxy-6-fluoro-1-O-phosphono-alpha-D-glucose
Definition date:	2018-09-28
Last modified:	2020-07-17
Release date:	2019-07-31
Identifier:	6-deoxy-6-fluoro-1-O-phosphono-alpha-D-glucopyranose

JVA

JVA
Name:	2,6-anhydro-5,7-dideoxy-5-fluoro-7-phosphono-D-glycero-D-manno-heptitol
Formula:	C7 H14 F O7 P
SMILES:	C1(OC(C(C(C1F)O)O)CO)CP(O)(O)=O
InChi:	InChI=1S/C7H14FO7P/c8-5-4(2-16(12,13)14)15-3(1-9)6(10)7(5)11/h3-7,9-11H,1-2H2,(H2,12,13,14)/t3-,4-,5-,6-,7-/m1/s1
Definition date:	2018-10-01
Last modified:	2020-07-17
Release date:	2019-07-31
Identifier:	2,6-anhydro-5,7-dideoxy-5-fluoro-7-phosphono-D-glycero-D-manno-heptitol

JVS

JVS
Name:	1-deoxy-1-fluoro-2-O-phosphono-alpha-D-gluco-hept-2-ulopyranose
Formula:	C7 H14 F O9 P
SMILES:	C1(C(C(CF)(OC(C1O)CO)OP(O)(=O)O)O)O
InChi:	InChI=1S/C7H14FO9P/c8-2-7(17-18(13,14)15)6(12)5(11)4(10)3(1-9)16-7/h3-6,9-12H,1-2H2,(H2,13,14,15)/t3-,4-,5+,6-,7-/m1/s1
Synonyms:	1-deoxy-1-fluoro-2-O-phosphono-alpha-D-gluco-hept-2-ulose
Definition date:	2018-10-04
Last modified:	2020-07-17
Release date:	2019-07-31
Identifier:	1-deoxy-1-fluoro-2-O-phosphono-alpha-D-gluco-hept-2-ulopyranose

KFN

KFN
Name:	2,6-anhydro-3-deoxy-D-glycero-D-galacto-non-2-enonic acid
Formula:	C9 H14 O8
SMILES:	OC[CH](O)[CH](O)[CH]1OC(=C[CH](O)[CH]1O)C(O)=O
InChi:	InChI=1S/C9H14O8/c10-2-4(12)7(14)8-6(13)3(11)1-5(17-8)9(15)16/h1,3-4,6-8,10-14H,2H2,(H,15,16)/t3-,4+,6+,7+,8+/m0/s1
Synonyms:	(4S,5R,6R)-4,5-DIHYDROXY-6-[(1R,2R)-1,2,3-TRIHYDROXYPROPYL]-5,6-DIHYDRO-4H-PYRAN-2-CARBOXYLIC ACID
Definition date:	2010-11-26
Last modified:	2020-07-17
Identifier:	(4S,5R,6R)-4,5-dihydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-5,6-dihydro-4H-pyran-2-carboxylic acid

KG1

KG1
Name:	propadienyl 6-deoxy-alpha-L-galactopyranoside
Formula:	C9 H14 O5
SMILES:	C[CH]1O[CH](O[CH]=[C]=[CH2])[CH](O)[CH](O)[CH]1O
InChi:	InChI=1S/C9H14O5/c1-3-4-13-9-8(12)7(11)6(10)5(2)14-9/h4-12H,1H2,2H3/t5-,6+,7+,8-,9+/m0/s1
Synonyms:	propargyl-fucoside
Definition date:	2017-12-04
Last modified:	2020-07-17
Release date:	2018-01-31
Identifier:	(2~{S},3~{S},4~{R},5~{S},6~{R})-2-methyl-6-propa-1,2-dienoxy-oxane-3,4,5-triol

KGM

KGM
Name:	heptyl alpha-D-mannopyranoside
Formula:	C13 H26 O6
SMILES:	O(CCCCCCC)C1OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C13H26O6/c1-2-3-4-5-6-7-18-13-12(17)11(16)10(15)9(8-14)19-13/h9-17H,2-8H2,1H3/t9-,10-,11+,12+,13+/m1/s1
Synonyms:	Heptyl Alpha-D-mannopyrannoside
Definition date:	2013-06-23
Last modified:	2020-07-17
Release date:	2014-02-12
Identifier:	heptyl alpha-D-mannopyranoside

KHP

KHP
Name:	4-nitrophenyl alpha-L-arabinofuranoside
Formula:	C11 H13 N O7
SMILES:	[O-][N+](=O)c2ccc(OC1OC(C(O)C1O)CO)cc2
InChi:	InChI=1S/C11H13NO7/c13-5-8-9(14)10(15)11(19-8)18-7-3-1-6(2-4-7)12(16)17/h1-4,8-11,13-15H,5H2/t8-,9-,10+,11+/m0/s1
Synonyms:	2-HYDROXYMETHYL-5-(4-NITRO-PHENOXY)-TETRAHYDRO-FURAN-3,4-DIOL
Definition date:	2003-09-12
Last modified:	2020-07-17
Identifier:	4-nitrophenyl alpha-L-arabinofuranoside

KME

KME
Name:	(1E)-prop-1-en-1-yl 3-deoxy-7-O-methyl-alpha-D-manno-oct-2-ulopyranosidonic acid
Formula:	C12 H20 O8
SMILES:	O=C(O)C1(O/C=C/C)OC(C(O)C(O)C1)C(OC)CO
InChi:	InChI=1S/C12H20O8/c1-3-4-19-12(11(16)17)5-7(14)9(15)10(20-12)8(6-13)18-2/h3-4,7-10,13-15H,5-6H2,1-2H3,(H,16,17)/b4-3+/t7-,8-,9-,10-,12-/m1/s1
Synonyms:	(1E)-prop-1-en-1-yl 3-deoxy-7-O-methyl-alpha-D-manno-oct-2-ulosidonic acid
Definition date:	2009-08-06
Last modified:	2020-07-17
Identifier:	(1E)-prop-1-en-1-yl 3-deoxy-7-O-methyl-alpha-D-manno-oct-2-ulopyranosidonic acid

KO1

KO1
Name:	D-glycero-alpha-D-talo-oct-2-ulopyranosonic acid
Formula:	C8 H14 O9
SMILES:	O=C(O)C1(O)OC(C(O)CO)C(O)C(O)C1O
InChi:	InChI=1S/C8H14O9/c9-1-2(10)5-3(11)4(12)6(13)8(16,17-5)7(14)15/h2-6,9-13,16H,1H2,(H,14,15)/t2-,3-,4+,5-,6+,8-/m1/s1
Synonyms:	D-glycero-alpha-D-talo-oct-2-ulosonic acid
Definition date:	2008-01-15
Last modified:	2020-07-17
Identifier:	D-glycero-alpha-D-talo-oct-2-ulopyranosonic acid

KO2

KO2
Name:	prop-2-en-1-yl D-glycero-alpha-D-talo-oct-2-ulopyranosidonic acid
Formula:	C11 H18 O9
SMILES:	O=C(O)C1(OCC=C)OC(C(O)CO)C(O)C(O)C1O
InChi:	InChI=1S/C11H18O9/c1-2-3-19-11(10(17)18)9(16)7(15)6(14)8(20-11)5(13)4-12/h2,5-9,12-16H,1,3-4H2,(H,17,18)/t5-,6-,7+,8-,9+,11-/m1/s1
Synonyms:	prop-2-en-1-yl D-glycero-alpha-D-talo-oct-2-ulosidonic acid
Definition date:	2008-01-18
Last modified:	2020-07-17
Identifier:	prop-2-en-1-yl D-glycero-alpha-D-talo-oct-2-ulopyranosidonic acid

KOT

KOT
Name:	1-beta-D-glucopyranosyl-4-phenyl-1H-1,2,3-triazole
Formula:	C14 H17 N3 O5
SMILES:	n1nn(cc1c2ccccc2)C3OC(C(O)C(O)C3O)CO
InChi:	InChI=1S/C14H17N3O5/c18-7-10-11(19)12(20)13(21)14(22-10)17-6-9(15-16-17)8-4-2-1-3-5-8/h1-6,10-14,18-21H,7H2/t10-,11-,12+,13-,14-/m1/s1
Synonyms:	1-beta-D-glucosyl-4-phenyl-1H-1,2,3-triazole
Definition date:	2009-02-05
Last modified:	2020-07-17
Identifier:	1-beta-D-glucopyranosyl-4-phenyl-1H-1,2,3-triazole

8B7

8B7
Name:	6-deoxy-alpha-L-galactopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranose
Formula:	C18 H32 O15
SMILES:	C3(OC2C(OC1C(C(C(OC1CO)O)O)O)OC(C(C2O)O)CO)C(O)C(O)C(O)C(O3)C
InChi:	InChI=1S/C18H32O15/c1-4-7(21)9(23)13(27)17(29-4)33-15-10(24)8(22)5(2-19)31-18(15)32-14-6(3-20)30-16(28)12(26)11(14)25/h4-28H,2-3H2,1H3/t4-,5+,6+,7+,8-,9+,10-,11+,12+,13-,14+,15+,16+,17-,18-/m0/s1
Definition date:	2017-01-17
Last modified:	2020-07-17
Release date:	2017-10-18
Identifier:	6-deoxy-alpha-L-galactopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->4)-beta-D-glucopyranose

045

045
Name:	beta-D-fructofuranosyl-(2->6)-beta-D-fructofuranosyl alpha-D-glucopyranoside
Formula:	C18 H32 O16
SMILES:	O1C(CO)C(O)C(O)C(O)C1OC2(OC(C(O)C2O)COC3(OC(CO)C(O)C3O)CO)CO
InChi:	InChI=1S/C18H32O16/c19-1-6-9(23)12(26)13(27)16(31-6)34-18(5-22)15(29)11(25)8(33-18)3-30-17(4-21)14(28)10(24)7(2-20)32-17/h6-16,19-29H,1-5H2/t6-,7-,8-,9-,10-,11-,12+,13-,14+,15+,16-,17-,18+/m1/s1
Synonyms:	6-KESTOSE
Definition date:	2011-11-04
Last modified:	2020-07-17
Identifier:	beta-D-fructofuranosyl-(2->6)-beta-D-fructofuranosyl alpha-D-glucopyranoside

8EX

8EX
Name:	2-acetamido-2-deoxy-4,6-di-O-sulfo-beta-D-galactopyranose
Formula:	C8 H15 N O12 S2
SMILES:	CC(=O)N[CH]1[CH](O)O[CH](CO[S](O)(=O)=O)[CH](O[S](O)(=O)=O)[CH]1O
InChi:	InChI=1S/C8H15NO12S2/c1-3(10)9-5-6(11)7(21-23(16,17)18)4(20-8(5)12)2-19-22(13,14)15/h4-8,11-12H,2H2,1H3,(H,9,10)(H,13,14,15)(H,16,17,18)/t4-,5-,6-,7+,8-/m1/s1
Synonyms:	[(2R,3R,4R,5R,6R)-5-acetamido-4,6-bis(oxidanyl)-2-(sulfooxymethyl)oxan-3-yl] hydrogen sulfate
Definition date:	2017-06-22
Last modified:	2020-07-17
Release date:	2018-01-17
Identifier:	[(2~{R},3~{R},4~{R},5~{R},6~{R})-5-acetamido-4,6-bis(oxidanyl)-2-(sulfooxymethyl)oxan-3-yl] hydrogen sulfate

05L

05L
Name:	heptyl 1-seleno-beta-D-glucopyranoside
Formula:	C13 H26 O5 Se
SMILES:	[Se](CCCCCCC)C1OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C13H26O5Se/c1-2-3-4-5-6-7-19-13-12(17)11(16)10(15)9(8-14)18-13/h9-17H,2-8H2,1H3/t9-,10-,11+,12-,13+/m1/s1
Synonyms:	heptyl 1-seleno-beta-D-glucoside
Definition date:	2011-11-29
Last modified:	2020-07-17
Identifier:	heptyl 1-seleno-beta-D-glucopyranoside

8GA

8GA
Name:	5-Se-methyl-5-seleno-alpha-D-ribofuranose
Formula:	C6 H12 O4 Se
SMILES:	C[Se]CC1OC(O)C(O)C1O
InChi:	InChI=1S/C6H12O4Se/c1-11-2-3-4(7)5(8)6(9)10-3/h3-9H,2H2,1H3/t3-,4-,5-,6+/m1/s1
Synonyms:	5-Se-methyl-5-seleno-alpha-D-ribose
Definition date:	2017-02-04
Last modified:	2020-07-17
Release date:	2018-09-12
Identifier:	5-Se-methyl-5-seleno-alpha-D-ribofuranose

8GG

8GG
Name:	5-Se-methyl-5-seleno-beta-D-ribofuranose
Formula:	C6 H12 O4 Se
SMILES:	O1C(C[Se]C)C(C(C1O)O)O
InChi:	InChI=1S/C6H12O4Se/c1-11-2-3-4(7)5(8)6(9)10-3/h3-9H,2H2,1H3/t3-,4-,5-,6-/m1/s1
Synonyms:	5-Se-methyl-5-seleno-beta-D-ribose
Definition date:	2017-02-04
Last modified:	2020-07-17
Release date:	2018-09-12
Identifier:	5-Se-methyl-5-seleno-beta-D-ribofuranose

8GP

8GP
Name:	N-[(cyclopropylamino)(oxo)acetyl]-beta-D-glucopyranosylamine
Formula:	C11 H18 N2 O7
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)C(=O)NC2CC2
InChi:	InChI=1S/C11H18N2O7/c14-3-5-6(15)7(16)8(17)11(20-5)13-10(19)9(18)12-4-1-2-4/h4-8,11,14-17H,1-3H2,(H,12,18)(H,13,19)/t5-,6-,7+,8-,11-/m1/s1
Synonyms:	N-(BETA-D-GLUCOPYRANOSYL)-N'-CYCLOPROPYL OXALAMIDE
Definition date:	2006-01-25
Last modified:	2020-07-17
Identifier:	N-[(cyclopropylamino)(oxo)acetyl]-beta-D-glucopyranosylamine

8LM

8LM
Name:	2,6-anhydro-3,5-dideoxy-5-[(2-methylpropanoyl)amino]-3-(4-phenyl-1H-1,2,3-triazol-1-yl)-D-glycero-D-galacto-non-2-enoni c acid
Formula:	C21 H26 N4 O8
SMILES:	C(=O)(NC1C(O)C(=C(C(O)=O)OC1C(C(CO)O)O)n3cc(c2ccccc2)nn3)C(C)C
InChi:	InChI=1S/C21H26N4O8/c1-10(2)20(30)22-14-17(29)15(19(21(31)32)33-18(14)16(28)13(27)9-26)25-8-12(23-24-25)11-6-4-3-5-7-11/h3-8,10,13-14,16-18,26-29H,9H2,1-2H3,(H,22,30)(H,31,32)/t13-,14-,16-,17-,18-/m1/s1
Definition date:	2017-02-15
Last modified:	2020-07-17
Release date:	2018-06-27
Identifier:	2,6-anhydro-3,5-dideoxy-5-[(2-methylpropanoyl)amino]-3-(4-phenyl-1H-1,2,3-triazol-1-yl)-D-glycero-D-galacto-non-2-enoni c acid

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