Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help
6LS
6LS
Name:heptyl 2-deoxy-alpha-D-mannopyranoside
Formula:C13 H26 O5
SMILES:CCCCCCCO[CH]1C[CH](O)[CH](O)[CH](CO)O1
InChi:InChI=1S/C13H26O5/c1-2-3-4-5-6-7-17-12-8-10(15)13(16)11(9-14)18-12/h10-16H,2-9H2,1H3/t10-,11-,12+,13+/m1/s1
Synonyms:2-Deoxy-Heptylmannoside
Definition date:2016-05-27
Last modified:2020-07-18
Release date:2017-06-21
Identifier:(2~{R},3~{S},4~{R},6~{S})-6-heptoxy-2-(hydroxymethyl)oxane-3,4-diol
ZEL
ZEL
Name:methyl beta-D-altropyranoside
Formula:C7 H14 O6
SMILES:OC1C(O)C(O)C(OC1OC)CO
InChi:InChI=1S/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3/t3-,4-,5-,6+,7-/m1/s1
Definition date:2012-12-18
Last modified:2020-07-17
Release date:2020-07-29
Identifier:methyl beta-D-altropyranoside
HSG
HSG
Name:octyl alpha-L-altropyranoside
Formula:C14 H28 O6
SMILES:O(CCCCCCCC)C1OC(C(O)C(O)C1O)CO
InChi:InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-14-13(18)12(17)11(16)10(9-15)20-14/h10-18H,2-9H2,1H3/t10-,11-,12-,13+,14+/m0/s1
Synonyms:octyl alpha-L-altroside
Definition date:2009-01-14
Last modified:2020-07-17
Identifier:octyl alpha-L-altropyranoside
HSH
HSH
Name:octyl beta-D-galactopyranoside
Formula:C14 H28 O6
SMILES:O(CCCCCCCC)C1OC(C(O)C(O)C1O)CO
InChi:InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-14-13(18)12(17)11(16)10(9-15)20-14/h10-18H,2-9H2,1H3/t10-,11+,12+,13-,14-/m1/s1
Synonyms:octyl beta-D-galactoside
Definition date:2009-01-14
Last modified:2020-07-17
Identifier:octyl beta-D-galactopyranoside
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
HSJ
HSJ
Name:octyl beta-L-talopyranoside
Formula:C14 H28 O6
SMILES:O(CCCCCCCC)C1OC(C(O)C(O)C1O)CO
InChi:InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-14-13(18)12(17)11(16)10(9-15)20-14/h10-18H,2-9H2,1H3/t10-,11+,12+,13+,14-/m0/s1
Synonyms:octyl beta-L-taloside
Definition date:2009-01-14
Last modified:2020-07-17
Release date:2014-07-30
Identifier:octyl beta-L-talopyranoside
LXZ
LXZ
Name:2-acetamido-2-deoxy-alpha-D-idopyranose
Formula:C8 H15 N O6
SMILES:O=C(NC1C(O)C(O)C(OC1O)CO)C
InChi:InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5+,6+,7+,8+/m1/s1
Synonyms:N-acetyl-alpha-D-idosamine
Definition date:2008-07-09
Last modified:2020-07-17
Identifier:2-(acetylamino)-2-deoxy-alpha-D-idopyranose
PNA
PNA
Name:4-nitrophenyl alpha-D-mannopyranoside
Formula:C12 H15 N O8
SMILES:[O-][N+](=O)c2ccc(OC1OC(C(O)C(O)C1O)CO)cc2
InChi:InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-6(2-4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11+,12+/m1/s1
Synonyms:4'-NITROPHENYL-ALPHA-D-MANNOPYRANOSIDE
Definition date:1999-07-08
Last modified:2020-07-17
Identifier:4-nitrophenyl alpha-D-mannopyranoside
HSQ
HSQ
Name:2-acetylamino-2-deoxy-alpha-L-idopyranose
Formula:C8 H15 N O6
SMILES:O=C(NC1C(O)C(O)C(OC1O)CO)C
InChi:InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5+,6+,7+,8+/m0/s1
Synonyms:N-acetyl-alpha-L-idosamine
Definition date:2009-01-16
Last modified:2020-07-17
Identifier:2-(acetylamino)-2-deoxy-alpha-L-idopyranose
SIA
SIA
Name:N-acetyl-alpha-neuraminic acid
Formula:C11 H19 N O9
SMILES:O=C(O)C1(O)OC(C(O)C(O)CO)C(NC(=O)C)C(O)C1
InChi:InChI=1S/C11H19NO9/c1-4(14)12-7-5(15)2-11(20,10(18)19)21-9(7)8(17)6(16)3-13/h5-9,13,15-17,20H,2-3H2,1H3,(H,12,14)(H,18,19)/t5-,6+,7+,8+,9+,11+/m0/s1
Synonyms:N-acetylneuraminic acid
Definition date:1999-07-08
Last modified:2020-07-17
Identifier:5-(acetylamino)-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosonic acid
PNG
PNG
Name:4-nitrophenyl alpha-D-glucopyranoside
Formula:C12 H15 N O8
SMILES:[O-][N+](=O)c2ccc(OC1OC(C(O)C(O)C1O)CO)cc2
InChi:InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-6(2-4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11-,12+/m1/s1
Synonyms:4'-NITROPHENYL-ALPHA-D-GLUCOPYRANOSIDE
Definition date:1999-07-08
Last modified:2020-07-17
Identifier:4-nitrophenyl alpha-D-glucopyranoside
MCU
MCU
Name:methyl 4-O-methyl-beta-D-glucopyranuronate
Formula:C8 H14 O7
SMILES:O=C(OC)C1OC(O)C(O)C(O)C1OC
InChi:InChI=1S/C8H14O7/c1-13-5-3(9)4(10)7(11)15-6(5)8(12)14-2/h3-7,9-11H,1-2H3/t3-,4-,5+,6+,7-/m1/s1
Synonyms:methyl (2S,3S,4R,5R,6R)-3-methoxy-4,5,6-tris(oxidanyl)oxane-2-carboxylate
Definition date:2012-07-18
Last modified:2020-07-17
Release date:2012-12-28
Identifier:methyl 4-O-methyl-beta-D-glucopyranuronate
SID
SID
Name:methyl 9-S-acetyl-5-acetamido-3,5-dideoxy-9-thio-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
Formula:C14 H23 N O9 S
SMILES:O=C(SCC(O)C(O)C1OC(OC)(C(=O)O)CC(O)C1NC(=O)C)C
InChi:InChI=1S/C14H23NO9S/c1-6(16)15-10-8(18)4-14(23-3,13(21)22)24-12(10)11(20)9(19)5-25-7(2)17/h8-12,18-20H,4-5H2,1-3H3,(H,15,16)(H,21,22)/t8-,9+,10+,11+,12+,14+/m0/s1
Synonyms:methyl 9-S-acetyl-5-(acetylamino)-3,5-dideoxy-9-thio-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
Definition date:2009-07-24
Last modified:2020-07-17
Identifier:methyl 9-S-acetyl-5-(acetylamino)-3,5-dideoxy-9-thio-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
HD4
HD4
Name:4-O-[2-acetamido-2-deoxy-beta-D-glucopyranosyl]-1-O-phosphono-D-ribitol
Formula:C13 H26 N O13 P
SMILES:C1(OC(CO)C(O)C(COP(O)(O)=O)O)C(NC(C)=O)C(C(C(O1)CO)O)O
InChi:InChI=1S/C13H26NO13P/c1-5(17)14-9-12(21)11(20)8(3-16)27-13(9)26-7(2-15)10(19)6(18)4-25-28(22,23)24/h6-13,15-16,18-21H,2-4H2,1H3,(H,14,17)(H2,22,23,24)/t6-,7+,8+,9+,10-,11+,12+,13+/m0/s1
Synonyms:4-O-[2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl]-1-O-phosphono-D-ribitol
Definition date:2018-06-26
Last modified:2020-07-17
Release date:2018-08-29
Identifier:4-O-[2-(acetylamino)-2-deoxy-beta-D-glucopyranosyl]-1-O-phosphono-D-ribitol
HSX
HSX
Name:5-O-phosphono-alpha-D-ribofuranose
Formula:C5 H11 O8 P
SMILES:O=P(O)(O)OCC1OC(O)C(O)C1O
InChi:InChI=1S/C5H11O8P/c6-3-2(1-12-14(9,10)11)13-5(8)4(3)7/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5+/m1/s1
Synonyms:5-O-phosphono-alpha-D-ribose
Definition date:2009-01-16
Last modified:2020-07-17
Identifier:5-O-phosphono-alpha-D-ribofuranose
PNJ
PNJ
Name:4-nitrophenyl 2-amino-2-deoxy-beta-D-glucopyranoside
Formula:C12 H16 N2 O7
SMILES:N[CH]1[CH](O)[CH](O)[CH](CO)O[CH]1Oc2ccc(cc2)[N+]([O-])=O
InChi:InChI=1S/C12H16N2O7/c13-9-11(17)10(16)8(5-15)21-12(9)20-7-3-1-6(2-4-7)14(18)19/h1-4,8-12,15-17H,5,13H2/t8-,9-,10-,11-,12-/m1/s1
Synonyms:PNP-BETA-D-GLUCOSAMINE
Definition date:2008-08-05
Last modified:2020-07-17
Identifier:(2~{R},3~{S},4~{R},5~{R},6~{S})-5-azanyl-2-(hydroxymethyl)-6-(4-nitrophenoxy)oxane-3,4-diol
HSY
HSY
Name:alpha-L-xylopyranose
Formula:C5 H10 O5
SMILES:OC1C(O)COC(O)C1O
InChi:InChI=1S/C5H10O5/c6-2-1-10-5(9)4(8)3(2)7/h2-9H,1H2/t2-,3+,4-,5+/m0/s1
Synonyms:alpha-L-xylose
Definition date:2009-01-16
Last modified:2020-07-17
Identifier:alpha-L-xylopyranose
VTB
VTB
Name:7-O-phosphono-alpha-L-galacto-hept-2-ulopyranose
Formula:C7 H15 O10 P
SMILES:OC[C]1(O)O[CH](CO[P](O)(O)=O)[CH](O)[CH](O)[CH]1O
InChi:InChI=1S/C7H15O10P/c8-2-7(12)6(11)5(10)4(9)3(17-7)1-16-18(13,14)15/h3-6,8-12H,1-2H2,(H2,13,14,15)/t3-,4+,5+,6-,7+/m0/s1
Synonyms:[(2~{S},3~{S},4~{R},5~{S},6~{R})-6-(hydroxymethyl)-3,4,5,6-tetrakis(oxidanyl)oxan-2-yl]methyl dihydrogen phosphate
Definition date:2015-06-19
Last modified:2020-07-17
Release date:2015-10-14
Identifier:[(2~{S},3~{S},4~{R},5~{S},6~{R})-6-(hydroxymethyl)-3,4,5,6-tetrakis(oxidanyl)oxan-2-yl]methyl dihydrogen phosphate
SIO
SIO
Name:methyl 4,9-di-O-acetyl-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
Formula:C16 H25 N O11
SMILES:O=C(OCC(O)C(O)C1OC(OC)(C(=O)O)CC(OC(=O)C)C1NC(=O)C)C
InChi:InChI=1S/C16H25NO11/c1-7(18)17-12-11(27-9(3)20)5-16(25-4,15(23)24)28-14(12)13(22)10(21)6-26-8(2)19/h10-14,21-22H,5-6H2,1-4H3,(H,17,18)(H,23,24)/t10-,11+,12-,13-,14-,16-/m1/s1
Synonyms:methyl 4,9-di-O-acetyl-5-(acetylamino)-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
Definition date:2008-03-20
Last modified:2020-07-17
Identifier:methyl 4,9-di-O-acetyl-5-(acetylamino)-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
A6P
A6P
Name:6-O-phosphono-alpha-D-allopyranose
Formula:C6 H13 O9 P
SMILES:O=P(O)(O)OCC1OC(O)C(O)C(O)C1O
InChi:InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4-,5-,6+/m1/s1
Synonyms:6-O-phosphono-alpha-D-allose
Definition date:2008-06-10
Last modified:2020-07-17
Identifier:6-O-phosphono-alpha-D-allopyranose
ZGE
ZGE
Name:5-acetamido-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-3-fluoro-D-glycero-D-galacto-non-2-enonic acid
Formula:C12 H19 F N4 O7
SMILES:O=C(C)NC1C(N/C(N)=N)C(F)=C(OC1C(O)C(CO)O)C(O)=O
InChi:InChI=1S/C12H19FN4O7/c1-3(19)16-7-6(17-12(14)15)5(13)9(11(22)23)24-10(7)8(21)4(20)2-18/h4,6-8,10,18,20-21H,2H2,1H3,(H,16,19)(H,22,23)(H4,14,15,17)/t4-,6+,7-,8-,10-/m1/s1
Synonyms:(2R,3R,4R)-3-acetamido-4-carbamimidamido-5-fluoranyl-2-[(1R,2R)-1,2,3-tris(oxidanyl)propyl]-3,4-dihydro-2H-pyran-6-carb oxylic acid
Definition date:2012-10-31
Last modified:2020-07-17
Release date:2013-05-01
Identifier:5-(acetylamino)-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-3-fluoro-D-glycero-D-galacto-non-2-enonic acid
PNW
PNW
Name:4-nitrophenyl beta-D-glucopyranoside
Formula:C12 H15 N O8
SMILES:[O-][N+](=O)c2ccc(OC1OC(C(O)C(O)C1O)CO)cc2
InChi:InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-6(2-4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
Synonyms:4'-NITROPHENYL-BETA-D-GLUCOPYRANOSIDE
Definition date:2010-05-25
Last modified:2020-07-17
Identifier:4-nitrophenyl beta-D-glucopyranoside
MDA
MDA
Name:2,6-dideoxy-3-C-methyl-beta-D-ribo-hexopyranose
Formula:C7 H14 O4
SMILES:OC1(C)C(O)C(OC(O)C1)C
InChi:InChI=1S/C7H14O4/c1-4-6(9)7(2,10)3-5(8)11-4/h4-6,8-10H,3H2,1-2H3/t4-,5-,6-,7+/m1/s1
Synonyms:2,6-DIDEOXY-3 C-METHYL-D-RIBOPYRANOSIDE
Definition date:1999-07-08
Last modified:2020-07-17
Identifier:2,6-dideoxy-3-C-methyl-beta-D-ribo-hexopyranose
TQY
TQY
Name:6-O-octanoyl-alpha-D-glucopyranose
Formula:C14 H26 O7
SMILES:C(=O)(CCCCCCC)OCC1C(C(C(C(O1)O)O)O)O
InChi:InChI=1S/C14H26O7/c1-2-3-4-5-6-7-10(15)20-8-9-11(16)12(17)13(18)14(19)21-9/h9,11-14,16-19H,2-8H2,1H3/t9-,11-,12+,13-,14+/m1/s1
Definition date:2020-03-30
Last modified:2020-07-17
Release date:2020-07-29
Identifier:6-O-octanoyl-alpha-D-glucopyranose
SIZ
SIZ
Name:2-deoxy-2-[(difluoroacetyl)amino]-beta-D-galactopyranose
Formula:C8 H13 F2 N O6
SMILES:OC[CH]1O[CH](O)[CH](NC(=O)C(F)F)[CH](O)[CH]1O
InChi:InChI=1S/C8H13F2NO6/c9-6(10)7(15)11-3-5(14)4(13)2(1-12)17-8(3)16/h2-6,8,12-14,16H,1H2,(H,11,15)/t2-,3-,4+,5-,8-/m1/s1
Synonyms:N-DIFLUOROACETYL-D-GALACTOSAMINE
Definition date:2015-12-14
Last modified:2020-07-17
Release date:2016-03-30
Identifier:2,2-bis(fluoranyl)-N-[(2R,3R,4R,5R,6R)-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]ethanamide

221051

数据于2024-06-12公开中

PDB statisticsPDBj update infoContact PDBjnumon