Loading
PDBj
MenuPDBj@FacebookPDBj@X(formerly Twitter)PDBj@BlueSkyPDBj@YouTubewwPDB FoundationwwPDBDonate
RCSB PDBPDBeBMRBAdv. SearchSearch help
MRH
MRH
Name:4-acetamido-4,6-dideoxy-alpha-D-mannopyranose
Formula:C8 H15 N O5
SMILES:C[CH]1O[CH](O)[CH](O)[CH](O)[CH]1NC(C)=O
InChi:InChI=1S/C8H15NO5/c1-3-5(9-4(2)10)6(11)7(12)8(13)14-3/h3,5-8,11-13H,1-2H3,(H,9,10)/t3-,5-,6+,7+,8+/m1/s1
Synonyms:alpha-N-Acetylperosamine
Definition date:2019-10-21
Last modified:2020-07-17
Release date:2020-01-15
Identifier:~{N}-[(2~{R},3~{S},4~{S},5~{S},6~{S})-2-methyl-4,5,6-tris(oxidanyl)oxan-3-yl]ethanamide
MRP
MRP
Name:3-O-methyl-alpha-L-rhamnopyranose
Formula:C7 H14 O5
SMILES:O(C1C(O)C(OC(O)C1O)C)C
InChi:InChI=1S/C7H14O5/c1-3-4(8)6(11-2)5(9)7(10)12-3/h3-10H,1-2H3/t3-,4-,5+,6+,7+/m0/s1
Synonyms:3-O-METHYL-ALPHA-L-RHAMNOPYRANOSIDE
Definition date:1999-07-08
Last modified:2020-07-17
Identifier:6-deoxy-3-O-methyl-alpha-L-mannopyranose
MSX
MSX
Name:methyl 1,6-dithio-alpha-D-mannopyranoside
Formula:C7 H14 O4 S2
SMILES:OC1C(O)C(O)C(OC1SC)CS
InChi:InChI=1S/C7H14O4S2/c1-13-7-6(10)5(9)4(8)3(2-12)11-7/h3-10,12H,2H2,1H3/t3-,4-,5+,6+,7-/m1/s1
Synonyms:1,6-DIDEOXY-DITHIO-METHYL-ALPHA-D-MANNOSE
Definition date:2014-10-27
Last modified:2020-07-17
Release date:2015-03-25
Identifier:methyl 1,6-dithio-alpha-D-mannopyranoside
1S3
1S3
Name:(2R,3aR,5R,6S,7S,7aR)-5-(hydroxymethyl)tetrahydro-3aH-[1,3,2]dioxaphospholo[4,5-b]pyran-2,6,7-triol 2-oxide
Formula:C6 H11 O8 P
SMILES:O=P1(OC2C(O)C(O)C(OC2O1)CO)O
InChi:InChI=1S/C6H11O8P/c7-1-2-3(8)4(9)5-6(12-2)14-15(10,11)13-5/h2-9H,1H2,(H,10,11)/t2-,3-,4+,5-,6-/m1/s1
Synonyms:Glucose1,2cyclic phosphate
Definition date:2013-05-15
Last modified:2020-07-17
Release date:2013-12-11
Identifier:(2R,3aR,5R,6S,7S,7aR)-5-(hydroxymethyl)tetrahydro-3aH-[1,3,2]dioxaphospholo[4,5-b]pyran-2,6,7-triol 2-oxide
1S4
1S4
Name:alpha-muramic acid
Formula:C9 H17 N O7
SMILES:O=C(O)C(OC1C(O)C(OC(O)C1N)CO)C
InChi:InChI=1S/C9H17NO7/c1-3(8(13)14)16-7-5(10)9(15)17-4(2-11)6(7)12/h3-7,9,11-12,15H,2,10H2,1H3,(H,13,14)/t3-,4-,5-,6-,7-,9+/m1/s1
Synonyms:muramic acid
Definition date:2013-05-15
Last modified:2020-07-17
Release date:2020-07-29
Identifier:2-amino-3-O-[(1R)-1-carboxyethyl]-2-deoxy-alpha-D-glucopyranose
1SD
1SD
Name:(1S)-1,5-anhydro-1-sulfamoyl-D-galactitol
Formula:C6 H13 N O7 S
SMILES:O=S(=O)(N)C1OC(C(O)C(O)C1O)CO
InChi:InChI=1S/C6H13NO7S/c7-15(12,13)6-5(11)4(10)3(9)2(1-8)14-6/h2-6,8-11H,1H2,(H2,7,12,13)/t2-,3+,4+,5-,6+/m1/s1
Synonyms:(2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxane-2-sulfonamide
Definition date:2009-06-02
Last modified:2020-07-17
Identifier:(1S)-1,5-anhydro-1-sulfamoyl-D-galactitol
LNV
LNV
Name:5-acetamido-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-7-O-methyl-D-glycero-D-galacto-non-2-enonic acid
Formula:C13 H22 N4 O7
SMILES:O=C(O)C=1OC(C(OC)C(O)CO)C(NC(=O)C)C(C=1)NC(=[N@H])N
InChi:InChI=1S/C13H22N4O7/c1-5(19)16-9-6(17-13(14)15)3-8(12(21)22)24-11(9)10(23-2)7(20)4-18/h3,6-7,9-11,18,20H,4H2,1-2H3,(H,16,19)(H,21,22)(H4,14,15,17)/t6-,7+,9+,10+,11+/m0/s1
Synonyms:5-(acetylamino)-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-7-O-methyl-D-glycero-D-galacto-non-2-enonic acid
Definition date:2011-09-01
Last modified:2020-07-17
Identifier:5-(acetylamino)-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-7-O-methyl-D-glycero-D-galacto-non-2-enonic acid
LOG
LOG
Name:N-acetylglucosaminono-1,5-lactone (Z)-oxime
Formula:C8 H14 N2 O6
SMILES:O=C(NC1C(=NO)OC(CO)C(O)C1O)C
InChi:InChI=1S/C8H14N2O6/c1-3(12)9-5-7(14)6(13)4(2-11)16-8(5)10-15/h4-7,11,13-15H,2H2,1H3,(H,9,12)/b10-8-/t4-,5-,6-,7-/m1/s1
Synonyms:LOGNAC
Definition date:2010-07-22
Last modified:2020-07-17
Identifier:N-[(2Z,3R,4R,5S,6R)-4,5-dihydroxy-2-(hydroxyimino)-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl]acetamide (non-preferred name)
LOX
LOX
Name:(2Z,3S,4S,5R)-2-hydroxyiminopiperidine-3,4,5-triol
Formula:C5 H10 N2 O4
SMILES:OC1C(=NO)NCC(O)C1O
InChi:InChI=1S/C5H10N2O4/c8-2-1-6-5(7-11)4(10)3(2)9/h2-4,8-11H,1H2,(H,6,7)/t2-,3+,4-/m1/s1
Synonyms:3,4,5-TRIHYDOXY-PIPERIDINE-2-ONE-OXIME
Definition date:2000-08-17
Last modified:2020-07-17
Identifier:(2Z,3S,4S,5R)-3,4,5-trihydroxypiperidin-2-one oxime
LRH
LRH
Name:6-deoxy-beta-L-fructofuranose
Formula:C6 H12 O5
SMILES:OC1C(O)C(OC1(O)CO)C
InChi:InChI=1S/C6H12O5/c1-3-4(8)5(9)6(10,2-7)11-3/h3-5,7-10H,2H2,1H3/t3-,4-,5+,6-/m0/s1
Synonyms:6-deoxy-beta-L-fructose
Definition date:2007-04-13
Last modified:2020-07-17
Identifier:6-deoxy-beta-L-fructofuranose
1X4
1X4
Name:2,3-dideoxy-5-O-phosphono-alpha-D-ribofuranose
Formula:C5 H11 O6 P
SMILES:O=P(OCC1OC(O)CC1)(O)O
InChi:InChI=1S/C5H11O6P/c6-5-2-1-4(11-5)3-10-12(7,8)9/h4-6H,1-3H2,(H2,7,8,9)/t4-,5-/m0/s1
Synonyms:2,3-dideoxyribose-5-phosphate
Definition date:2013-07-22
Last modified:2020-07-17
Release date:2013-07-31
Identifier:[(2S,5S)-5-hydroxytetrahydrofuran-2-yl]methyl dihydrogen phosphate
20S
20S
Name:BETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-ALPHA-D-GLUCOPYRANOSIDE
Formula:C20 H36 O12
SMILES:O=C(OCC2OC(OC1(OC(C(O)C1O)CO)CO)C(O)C(O)C2O)CCCCCCC
InChi:InChI=1S/C20H36O12/c1-2-3-4-5-6-7-13(23)29-9-12-14(24)16(26)17(27)19(30-12)32-20(10-22)18(28)15(25)11(8-21)31-20/h11-12,14-19,21-22,24-28H,2-10H2,1H3/t11-,12-,14-,15-,16+,17-,18+,19-,20+/m1/s1
Definition date:2006-01-05
Last modified:2020-07-17
Identifier:beta-D-fructofuranosyl 6-O-octanoyl-alpha-D-glucopyranoside
20X
20X
Name:N-({(2E)-2-[(4-fluorophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine
Formula:C14 H18 F N3 O5 S
SMILES:S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2ccc(F)cc2
InChi:InChI=1S/C14H18FN3O5S/c15-8-3-1-7(2-4-8)5-16-18-14(24)17-13-12(22)11(21)10(20)9(6-19)23-13/h1-5,9-13,19-22H,6H2,(H2,17,18,24)/b16-5+/t9-,10-,11+,12-,13-/m1/s1
Synonyms:4-fluorobenzaldehyde-4-(beta-D-glucopyranosyl)-thiosemicarbazone
Definition date:2010-04-30
Last modified:2020-07-17
Identifier:N-{[(2E)-2-(4-fluorobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine
LVO
LVO
Name:5-acetamido-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-7-O-methyl-9-O-octanoyl-D-glycero-D-galacto-non-2-enonic acid
Formula:C21 H36 N4 O8
SMILES:O=C(OCC(O)C(OC)C1OC(=CC(NC(=[N@H])N)C1NC(=O)C)C(=O)O)CCCCCCC
InChi:InChI=1S/C21H36N4O8/c1-4-5-6-7-8-9-16(28)32-11-14(27)18(31-3)19-17(24-12(2)26)13(25-21(22)23)10-15(33-19)20(29)30/h10,13-14,17-19,27H,4-9,11H2,1-3H3,(H,24,26)(H,29,30)(H4,22,23,25)/t13-,14+,17+,18+,19+/m0/s1
Synonyms:5-(acetylamino)-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-7-O-methyl-9-O-octanoyl-D-glycero-D-galacto-non-2-enonic acid
Definition date:2011-09-07
Last modified:2020-07-17
Identifier:5-(acetylamino)-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-7-O-methyl-9-O-octanoyl-D-glycero-D-galacto-non-2-enonic acid
LVQ
LVQ
Name:octa-anionic calixarene
Formula:C38 H37 As Na O25 S4
SMILES:C[As-](C)(O)OC1=[O+][Na]2345OC(=O)C[O+]2c6c7Cc8cc(cc(Cc9cc(cc(Cc%10cc(cc(Cc6cc(c7)[S](O)(=O)=O)c%10[O+]3CC(O)=O)[S](O)(=O)=O)c9[O+]4C1)[S](O)(=O)=O)c8[O+]5CC(O)=O)[S](O)(=O)=O
InChi:InChI=1S/C38H38AsO25S4.Na/c1-39(2,47)64-34(46)18-63-38-25-5-23-11-28(66(51,52)53)9-21(36(23)61-16-32(42)43)3-19-7-27(65(48,49)50)8-20(35(19)60-15-31(40)41)4-22-10-29(67(54,55)56)12-24(37(22)62-17-33(44)45)6-26(38)14-30(13-25)68(57,58)59
Definition date:2019-09-17
Last modified:2020-07-17
Release date:2020-07-22
LVZ
LVZ
Name:propan-2-yl 2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranoside
Formula:C9 H19 N O11 S2
SMILES:O=S(=O)(O)OCC1OC(OC(C)C)C(NS(=O)(=O)O)C(O)C1O
InChi:InChI=1S/C9H19NO11S2/c1-4(2)20-9-6(10-22(13,14)15)8(12)7(11)5(21-9)3-19-23(16,17)18/h4-12H,3H2,1-2H3,(H,13,14,15)(H,16,17,18)/t5-,6-,7-,8-,9+/m1/s1
Synonyms:propan-2-yl 2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucoside
Definition date:2012-07-18
Last modified:2020-07-17
Release date:2013-07-31
Identifier:propan-2-yl 2-deoxy-6-O-sulfo-2-(sulfoamino)-alpha-D-glucopyranoside
22O
22O
Name:N-({(2E)-2-[(3-bromophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine
Formula:C14 H18 Br N3 O5 S
SMILES:S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2cccc(Br)c2
InChi:InChI=1S/C14H18BrN3O5S/c15-8-3-1-2-7(4-8)5-16-18-14(24)17-13-12(22)11(21)10(20)9(6-19)23-13/h1-5,9-13,19-22H,6H2,(H2,17,18,24)/b16-5+/t9-,10-,11+,12-,13-/m1/s1
Synonyms:3-bromobenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone
Definition date:2010-05-03
Last modified:2020-07-17
Identifier:N-{[(2E)-2-(3-bromobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine
22S
22S
Name:N-({(2E)-2-[(2-chlorophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine
Formula:C14 H18 Cl N3 O5 S
SMILES:S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2ccccc2Cl
InChi:InChI=1S/C14H18ClN3O5S/c15-8-4-2-1-3-7(8)5-16-18-14(24)17-13-12(22)11(21)10(20)9(6-19)23-13/h1-5,9-13,19-22H,6H2,(H2,17,18,24)/b16-5+/t9-,10-,11+,12-,13-/m1/s1
Synonyms:2-chlorobenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone
Definition date:2010-04-30
Last modified:2020-07-17
Identifier:N-{[(2E)-2-(2-chlorobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine
LXC
LXC
Name:beta-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:beta-L-xylose
Definition date:2002-03-13
Last modified:2020-07-17
Identifier:beta-L-xylopyranose
23V
23V
Name:N-({(2E)-2-[(3-chlorophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine
Formula:C14 H18 Cl N3 O5 S
SMILES:S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2cccc(Cl)c2
InChi:InChI=1S/C14H18ClN3O5S/c15-8-3-1-2-7(4-8)5-16-18-14(24)17-13-12(22)11(21)10(20)9(6-19)23-13/h1-5,9-13,19-22H,6H2,(H2,17,18,24)/b16-5+/t9-,10-,11+,12-,13-/m1/s1
Synonyms:3-chlorobenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone
Definition date:2010-05-03
Last modified:2020-07-17
Identifier:N-{[(2E)-2-(3-chlorobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine
LZ0
LZ0
Name:[1-(2-oxoethyl)-1H-1,2,3-triazol-5-yl]methyl 6-deoxy-alpha-L-galactopyranoside
Formula:C11 H17 N3 O6
SMILES:O=CCn1nncc1COC2OC(C(O)C(O)C2O)C
InChi:InChI=1S/C11H17N3O6/c1-6-8(16)9(17)10(18)11(20-6)19-5-7-4-12-13-14(7)2-3-15/h3-4,6,8-11,16-18H,2,5H2,1H3/t6-,8+,9+,10-,11+/m0/s1
Synonyms:[1-(2-oxoethyl)-1H-1,2,3-triazol-5-yl]methyl 6-deoxy-alpha-L-galactoside
Definition date:2008-05-22
Last modified:2020-07-17
Identifier:[1-(2-oxoethyl)-1H-1,2,3-triazol-5-yl]methyl 6-deoxy-alpha-L-galactopyranoside
24S
24S
Name:N-({(2Z)-2-[(2-nitrophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine
Formula:C14 H18 N4 O7 S
SMILES:S=C(NC1OC(C(O)C(O)C1O)CO)N/N=Cc2ccccc2[N+]([O-])=O
InChi:InChI=1S/C14H18N4O7S/c19-6-9-10(20)11(21)12(22)13(25-9)16-14(26)17-15-5-7-3-1-2-4-8(7)18(23)24/h1-5,9-13,19-22H,6H2,(H2,16,17,26)/b15-5-/t9-,10-,11+,12-,13-/m1/s1
Synonyms:2-nitrobenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone
Definition date:2010-05-03
Last modified:2020-07-17
Identifier:N-{[(2Z)-2-(2-nitrobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine
ABD
ABD
Name:ACARBOSE DERIVED HEXASACCHARIDE
Formula:C36 H63 N O29
SMILES:O(C1C(OC(O)C(O)C1O)CO)C6OC(C(OC5OC(C)C(NC4OC(CO)C(OC3OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C3O)C(O)C4O)C(O)C5O)C(O)C6O)CO
InChi:InChI=1S/C36H63NO29/c1-7-13(15(44)23(52)33(57-7)63-29-11(5-41)61-36(25(54)19(29)48)65-28-10(4-40)59-32(56)22(51)18(28)47)37-31-21(50)17(46)27(9(3-39)58-31)64-35-26(55)20(49)30(12(6-42)62-35)66-34-24(53)16(45)14(43)8(2-38)60-34/h7-56H,2-6H2,1H3/t7-,8-,9-,10-,11-,12-,13-,14-,15+,16+,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31+,32-,33-,34-,35-,36-/m1/s1
Definition date:1999-07-08
Last modified:2020-07-17
Identifier:(2R,3R,4R,5S,6R)-5-{[(2R,3R,4R,5S,6R)-5-{[(2R,3R,4S,5S,6R)-5-{[(2S,3R,4R,5S,6R)-5-{[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]amino}-3,4-dihydroxy-6-methyltetrahydro-2H-pyran-2-yl]oxy}-3,4-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-6-(hydroxymethyl)tetrahydro-2H-pyran-2,3,4-triol (non-preferred name)
ABE
ABE
Name:alpha-D-Abequopyranose
Formula:C6 H12 O4
SMILES:OC1C(OC(O)C(O)C1)C
InChi:InChI=1S/C6H12O4/c1-3-4(7)2-5(8)6(9)10-3/h3-9H,2H2,1H3/t3-,4-,5-,6+/m1/s1
Synonyms:alpha-D-Abequose
Definition date:1999-07-08
Last modified:2020-07-17
Identifier:3,6-dideoxy-alpha-D-xylo-hexopyranose
ABF
ABF
Name:5-O-phosphono-beta-D-arabinofuranose
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:BETA-D-ARABINOFURANOSE-5'-PHOSPHATE
Definition date:2002-11-26
Last modified:2020-07-17
Identifier:5-O-phosphono-beta-D-arabinofuranose

237992

数据于2025-06-25公开中

PDB statisticsPDBj update infoContact PDBjnumon