| GU0 | Name: | 2,3,6-tri-O-sulfonato-beta-D-glucopyranose | Formula: | C6 H9 O15 S3 | SMILES: | [O-]S(=O)(=O)OCC1OC(O)C(OS([O-])(=O)=O)C(OS([O-])(=O)=O)C1O | InChi: | InChI=1S/C6H12O15S3/c7-3-2(1-18-22(9,10)11)19-6(8)5(21-24(15,16)17)4(3)20-23(12,13)14/h2-8H,1H2,(H,9,10,11)(H,12,13,14)(H,15,16,17)/p-3/t2-,3-,4+,5-,6-/m1/s1 | Synonyms: | 2,3,6-tri-O-sulfonato-beta-D-glucose | Definition date: | 2004-06-22 | Last modified: | 2020-07-17 | Identifier: | 2,3,6-tri-O-sulfonato-beta-D-glucopyranose |
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| GU1 | Name: | 2,3-di-O-methyl-beta-D-glucopyranuronic acid | Formula: | C8 H14 O7 | SMILES: | O=C(O)C1OC(O)C(OC)C(OC)C1O | InChi: | InChI=1S/C8H14O7/c1-13-4-3(9)5(7(10)11)15-8(12)6(4)14-2/h3-6,8-9,12H,1-2H3,(H,10,11)/t3-,4-,5-,6+,8+/m0/s1 | Synonyms: | 2,3-di-O-methyl-beta-D-glucuronic acid | Definition date: | 2004-06-22 | Last modified: | 2020-07-17 | Identifier: | 2,3-di-O-methyl-beta-D-glucopyranuronic acid |
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| GU2 | Name: | 2,3-di-O-methyl-alpha-L-idopyranuronic acid | Formula: | C8 H14 O7 | SMILES: | O=C(O)C1OC(O)C(OC)C(OC)C1O | InChi: | InChI=1S/C8H14O7/c1-13-4-3(9)5(7(10)11)15-8(12)6(4)14-2/h3-6,8-9,12H,1-2H3,(H,10,11)/t3?,4-,5+,6+,8+/m0/s1 | Synonyms: | 2,3-di-O-methyl-alpha-L-iduronic acid | Definition date: | 2004-06-22 | Last modified: | 2020-07-17 | Identifier: | 2,3-di-O-methyl-alpha-L-idopyranuronic acid |
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| GU3 | Name: | methyl 3-O-methyl-2,6-di-O-sulfo-alpha-D-glucopyranoside | Formula: | C8 H16 O12 S2 | SMILES: | O=S(=O)(O)OCC1OC(OC)C(OS(=O)(=O)O)C(OC)C1O | InChi: | InChI=1S/C8H16O12S2/c1-16-6-5(9)4(3-18-21(10,11)12)19-8(17-2)7(6)20-22(13,14)15/h4-9H,3H2,1-2H3,(H,10,11,12)(H,13,14,15)/t4-,5-,6+,7-,8+/m1/s1 | Synonyms: | methyl 3-O-methyl-2,6-di-O-sulfo-alpha-D-glucoside | Definition date: | 2004-06-22 | Last modified: | 2020-07-17 | Identifier: | methyl 3-O-methyl-2,6-di-O-sulfo-alpha-D-glucopyranoside |
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| GU4 | Name: | 2,3,4,6-tetra-O-sulfonato-alpha-D-glucopyranose | Formula: | C6 H12 O18 S4 | SMILES: | OC1OC(COS(=O)(=O)O)C(OS(=O)(=O)O)C(OS(=O)(O)=O)C1OS(=O)(=O)O | InChi: | InChI=1S/C6H12O18S4/c7-6-5(24-28(17,18)19)4(23-27(14,15)16)3(22-26(11,12)13)2(21-6)1-20-25(8,9)10/h2-7H,1H2,(H,8,9,10)(H,11,12,13)(H,14,15,16)(H,17,18,19)/t2-,3-,4+,5-,6+/m1/s1 | Synonyms: | 2,3,4,6-tetra-O-sulfonato-alpha-D-glucose | Definition date: | 2004-06-22 | Last modified: | 2020-07-17 | Identifier: | 2,3,4,6-tetra-O-sulfo-alpha-D-glucopyranose |
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| GU5 | Name: | 2,3-di-O-methyl-6-O-sulfonato-alpha-D-glucopyranose | Formula: | C8 H15 O9 S | SMILES: | [O-]S(=O)(=O)OCC1OC(O)C(OC)C(OC)C1O | InChi: | InChI=1S/C8H16O9S/c1-14-6-5(9)4(3-16-18(11,12)13)17-8(10)7(6)15-2/h4-10H,3H2,1-2H3,(H,11,12,13)/p-1/t4-,5?,6+,7-,8+/m1/s1 | Synonyms: | 2,3-di-O-methyl-6-O-sulfonato-alpha-D-glucose | Definition date: | 2004-06-22 | Last modified: | 2020-07-17 | Identifier: | 2,3-di-O-methyl-6-O-sulfonato-alpha-D-glucopyranose |
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| GU6 | Name: | 2,3,6-tri-O-sulfo-alpha-D-glucopyranose | Formula: | C6 H12 O15 S3 | SMILES: | C1(C(C(OS(=O)(O)=O)C(O)C(COS(=O)(O)=O)O1)OS(O)(=O)=O)O | InChi: | InChI=1S/C6H12O15S3/c7-3-2(1-18-22(9,10)11)19-6(8)5(21-24(15,16)17)4(3)20-23(12,13)14/h2-8H,1H2,(H,9,10,11)(H,12,13,14)(H,15,16,17)/t2-,3-,4+,5-,6+/m1/s1 | Synonyms: | 2,3,6-TRI-O-SULFONATO-ALPHA-D-GLUCOPYRANOSE | Definition date: | 2004-06-22 | Last modified: | 2020-07-17 | Identifier: | 2,3,6-tri-O-sulfo-alpha-D-glucopyranose |
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| GU8 | Name: | 2,3,6-tri-O-methyl-beta-D-glucopyranose | Formula: | C9 H18 O6 | SMILES: | O(C)C1C(OC)C(O)C(OC1O)COC | InChi: | InChI=1S/C9H18O6/c1-12-4-5-6(10)7(13-2)8(14-3)9(11)15-5/h5-11H,4H2,1-3H3/t5-,6?,7+,8-,9-/m1/s1 | Synonyms: | 2,3,6-tri-O-methyl-beta-D-glucose | Definition date: | 2004-06-22 | Last modified: | 2020-07-17 | Identifier: | 2,3,6-tri-O-methyl-beta-D-glucopyranose |
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| GU9 | Name: | 2,3,6-tri-O-methyl-alpha-D-glucopyranose | Formula: | C9 H18 O6 | SMILES: | O(C)C1C(OC)C(O)C(OC1O)COC | InChi: | InChI=1S/C9H18O6/c1-12-4-5-6(10)7(13-2)8(14-3)9(11)15-5/h5-11H,4H2,1-3H3/t5-,6?,7+,8-,9+/m1/s1 | Synonyms: | 2,3,6-tri-O-methyl-alpha-D-glucose | Definition date: | 2004-06-22 | Last modified: | 2020-07-17 | Identifier: | 2,3,6-tri-O-methyl-alpha-D-glucopyranose |
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| GYG | Name: | (1R)-4-acetamido-1,5-anhydro-3-carbamimidamido-2,3,4-trideoxy-1-sulfo-D-glycero-D-galacto-octitol | Formula: | C11 H22 N4 O8 S | SMILES: | C1(CC(C(C(C(C(O)CO)O)O1)NC(C)=O)NC(N)=N)S(=O)(=O)O | InChi: | InChI=1S/C11H22N4O8S/c1-4(17)14-8-5(15-11(12)13)2-7(24(20,21)22)23-10(8)9(19)6(18)3-16/h5-10,16,18-19H,2-3H2,1H3,(H,14,17)(H4,12,13,15)(H,20,21,22)/t5-,6+,7+,8+,9+,10+/m0/s1 | Synonyms: | (1R)-4-(acetylamino)-1,5-anhydro-3-carbamimidamido-2,3,4-trideoxy-1-sulfo-D-glycero-D-galacto-octitol | Definition date: | 2017-11-30 | Last modified: | 2020-07-17 | Release date: | 2018-03-07 | Identifier: | (1R)-4-(acetylamino)-1,5-anhydro-3-carbamimidamido-2,3,4-trideoxy-1-sulfo-D-glycero-D-galacto-octitol |
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| GYU | Name: | 2-acetamido-2-deoxy-1-O-(propylcarbamoyl)-alpha-D-glucopyranose | Formula: | C12 H22 N2 O7 | SMILES: | O=C(OC1OC(C(O)C(O)C1NC(=O)C)CO)NCCC | InChi: | InChI=1S/C12H22N2O7/c1-3-4-13-12(19)21-11-8(14-6(2)16)10(18)9(17)7(5-15)20-11/h7-11,15,17-18H,3-5H2,1-2H3,(H,13,19)(H,14,16)/t7-,8-,9-,10-,11-/m1/s1 | Synonyms: | 2-(ACETYLAMINO)-2-DEOXY-1-O-(PROPYLCARBAMOYL)-ALPHA-D-GLUCOPYRANOSE | Definition date: | 2007-03-21 | Last modified: | 2020-07-17 | Identifier: | 2-(acetylamino)-2-deoxy-1-O-(propylcarbamoyl)-alpha-D-glucopyranose |
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| 1LL | Name: | thioditaloside | Formula: | C12 H22 O10 S | SMILES: | O2C(SC1OC(C(O)C(O)C1O)CO)C(O)C(O)C(O)C2CO | InChi: | InChI=1S/C12H22O10S/c13-1-3-5(15)7(17)9(19)11(21-3)23-12-10(20)8(18)6(16)4(2-14)22-12/h3-20H,1-2H2/t3-,4-,5+,6+,7+,8+,9+,10+,11+,12+/m1/s1 | Synonyms: | beta-D-talopyranosyl 1-thio-beta-D-talopyranoside | Definition date: | 2013-03-19 | Last modified: | 2020-07-17 | Release date: | 2013-07-31 | Identifier: | beta-D-talopyranosyl 1-thio-beta-D-talopyranoside |
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| H1M | Name: | methyl 2-deoxy-2-(2-hydroxyethyl)-alpha-D-mannopyranoside | Formula: | C9 H18 O6 | SMILES: | O(C)C1OC(C(O)C(O)C1CCO)CO | InChi: | InChI=1S/C9H18O6/c1-14-9-5(2-3-10)7(12)8(13)6(4-11)15-9/h5-13H,2-4H2,1H3/t5-,6+,7+,8+,9-/m0/s1 | Synonyms: | methyl 2-deoxy-2-(2-hydroxyethyl)-alpha-D-mannoside | Definition date: | 2008-05-19 | Last modified: | 2020-07-17 | Identifier: | methyl 2-deoxy-2-(2-hydroxyethyl)-alpha-D-mannopyranoside |
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| 0WK | Name: | 1,5-anhydro-6-O-phosphono-D-glucitol | Formula: | C6 H13 O8 P | SMILES: | O=P(O)(O)OCC1OCC(O)C(O)C1O | InChi: | InChI=1S/C6H13O8P/c7-3-1-13-4(6(9)5(3)8)2-14-15(10,11)12/h3-9H,1-2H2,(H2,10,11,12)/t3-,4+,5+,6+/m0/s1 | Definition date: | 2012-07-24 | Last modified: | 2020-07-17 | Release date: | 2013-07-03 | Identifier: | 1,5-anhydro-6-O-phosphono-D-glucitol |
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| H2P | Name: | 1-deoxy-2-O-phosphono-alpha-D-gluco-hept-2-ulopyranose | Formula: | C7 H15 O9 P | SMILES: | O=P(OC1(OC(C(O)C(O)C1O)CO)C)(O)O | InChi: | InChI=1S/C7H15O9P/c1-7(16-17(12,13)14)6(11)5(10)4(9)3(2-8)15-7/h3-6,8-11H,2H2,1H3,(H2,12,13,14)/t3-,4-,5+,6-,7-/m1/s1 | Synonyms: | HEPTULOSE-2-PHOSPHATE | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | 1-deoxy-2-O-phosphono-alpha-D-gluco-hept-2-ulopyranose |
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| 0XY | Name: | 5-fluoro-N-acetyl-alpha-D-glucosamine | Formula: | C8 H14 F N O6 | SMILES: | FC1(OC(O)C(NC(=O)C)C(O)C1O)CO | InChi: | InChI=1S/C8H14FNO6/c1-3(12)10-4-5(13)6(14)8(9,2-11)16-7(4)15/h4-7,11,13-15H,2H2,1H3,(H,10,12)/t4-,5-,6+,7?,8-/m1/s1 | Synonyms: | N-[(2S,3R,4R,5S,6S)-6-fluoro-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl]acetamide | Definition date: | 2012-09-05 | Last modified: | 2020-07-17 | Release date: | 2012-12-14 | Identifier: | N-[(2S,3R,4R,5S,6S)-6-fluoro-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-3-yl]acetamide (non-preferred name) |
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| 0YT | Name: | 2-acetamido-2-deoxy-5-thio-beta-D-glucopyranose | Formula: | C8 H15 N O5 S | SMILES: | O=C(NC1C(O)C(O)C(SC1O)CO)C | InChi: | InChI=1S/C8H15NO5S/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: | 2-(acetylamino)-2-deoxy-5-thio-beta-D-glucopyranose | Definition date: | 2012-09-18 | Last modified: | 2020-07-17 | Release date: | 2012-10-26 | Identifier: | 2-(acetylamino)-2-deoxy-5-thio-beta-D-glucopyranose |
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| 96O | Name: | (1-methyl-1H-1,2,3-triazol-4-yl)methyl alpha-D-mannopyranoside | Formula: | C10 H17 N3 O6 | SMILES: | C2(C(C(C(OCc1nnn(C)c1)OC2CO)O)O)O | InChi: | InChI=1S/C10H17N3O6/c1-13-2-5(11-12-13)4-18-10-9(17)8(16)7(15)6(3-14)19-10/h2,6-10,14-17H,3-4H2,1H3/t6-,7-,8+,9+,10+/m1/s1 | Synonyms: | (1-methyl-1H-1,2,3-triazol-4-yl)methyl alpha-D-mannoside | Definition date: | 2018-01-25 | Last modified: | 2020-07-17 | Release date: | 2019-04-10 | Identifier: | (1-methyl-1H-1,2,3-triazol-4-yl)methyl alpha-D-mannopyranoside |
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| 12E | Name: | N-{[(2E)-2-(pyridin-4-ylmethylidene)hydrazino]carbonothioyl}-beta-D-glucopyranosylamine | Formula: | C13 H18 N4 O5 S | SMILES: | S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2ccncc2 | InChi: | InChI=1S/C13H18N4O5S/c18-6-8-9(19)10(20)11(21)12(22-8)16-13(23)17-15-5-7-1-3-14-4-2-7/h1-5,8-12,18-21H,6H2,(H2,16,17,23)/b15-5+/t8-,9-,10+,11-,12-/m1/s1 | Synonyms: | 4-pyridinecarboxaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone | Definition date: | 2010-04-30 | Last modified: | 2020-07-17 | Identifier: | N-{[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine |
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| 145 | Name: | 2-nitrophenyl beta-D-galactopyranoside | Formula: | C12 H15 N O8 | SMILES: | [O-][N+](=O)c2c(OC1OC(C(O)C(O)C1O)CO)cccc2 | InChi: | InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-4-2-1-3-6(7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9+,10+,11-,12-/m1/s1 | Synonyms: | 1-O-[O-NITROPHENYL]-BETA-D-GALACTOPYRANOSE | Definition date: | 2001-09-26 | Last modified: | 2020-07-17 | Identifier: | 2-nitrophenyl beta-D-galactopyranoside |
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| 147 | Name: | 4-nitrophenyl beta-D-galactopyranoside | 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: | 1-O-[P-NITROPHENYL]-BETA-D-GALACTOPYRANOSE | Definition date: | 2001-09-27 | Last modified: | 2020-07-17 | Identifier: | 4-nitrophenyl beta-D-galactopyranoside |
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| 9AM | Name: | 9-AMINO-2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID | Formula: | C11 H18 N2 O7 | SMILES: | O=C(O)C=1OC(C(O)C(O)CN)C(NC(=O)C)C(O)C=1 | InChi: | InChI=1S/C11H18N2O7/c1-4(14)13-8-5(15)2-7(11(18)19)20-10(8)9(17)6(16)3-12/h2,5-6,8-10,15-17H,3,12H2,1H3,(H,13,14)(H,18,19)/t5-,6+,8+,9+,10+/m0/s1 | Definition date: | 2000-07-21 | Last modified: | 2020-07-17 | Identifier: | 5-(acetylamino)-9-amino-2,6-anhydro-3,5,9-trideoxy-D-glycero-D-galacto-non-2-enonic acid |
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| 14T | Name: | 3,4-difluorophenyl 2-deoxy-2-[(difluoroacetyl)amino]-beta-D-glucopyranoside | Formula: | C14 H15 F4 N O6 | SMILES: | FC(F)C(=O)NC2C(O)C(O)C(OC2Oc1cc(F)c(F)cc1)CO | InChi: | InChI=1S/C14H15F4NO6/c15-6-2-1-5(3-7(6)16)24-14-9(19-13(23)12(17)18)11(22)10(21)8(4-20)25-14/h1-3,8-12,14,20-22H,4H2,(H,19,23)/t8-,9-,10-,11-,14-/m1/s1 | Synonyms: | 3,4-difluorophenyl 2-deoxy-2-[(difluoroacetyl)amino]-beta-D-glucoside | Definition date: | 2009-12-08 | Last modified: | 2020-07-17 | Identifier: | 3,4-difluorophenyl 2-deoxy-2-[(difluoroacetyl)amino]-beta-D-glucopyranoside |
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| 9C1 | Name: | 2-{[(2E)-4-chlorobut-2-enoyl]amino}-2-deoxy-beta-D-glucopyranose | Formula: | C10 H16 Cl N O6 | SMILES: | C(=C/CCl)C(=O)NC1C(C(C(CO)OC1O)O)O | InChi: | InChI=1S/C10H16ClNO6/c11-3-1-2-6(14)12-7-9(16)8(15)5(4-13)18-10(7)17/h1-2,5,7-10,13,15-17H,3-4H2,(H,12,14)/b2-1+/t5-,7-,8-,9-,10-/m1/s1 | Synonyms: | 2-{[(2E)-4-chlorobut-2-enoyl]amino}-2-deoxy-beta-D-glucose | Definition date: | 2017-04-18 | Last modified: | 2020-07-17 | Release date: | 2017-10-18 | Identifier: | 2-{[(2E)-4-chlorobut-2-enoyl]amino}-2-deoxy-beta-D-glucopyranose |
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| 9CD | Name: | 2-{[(2E)-but-2-enoyl]amino}-2-deoxy-beta-D-glucopyranose | Formula: | C10 H17 N O6 | SMILES: | OC1C(C(OC(C1O)CO)O)NC([C@H]=CC)=O | InChi: | InChI=1S/C10H17NO6/c1-2-3-6(13)11-7-9(15)8(14)5(4-12)17-10(7)16/h2-3,5,7-10,12,14-16H,4H2,1H3,(H,11,13)/b3-2+/t5-,7-,8-,9-,10-/m1/s1 | Synonyms: | 2-{[(2E)-but-2-enoyl]amino}-2-deoxy-beta-D-glucose | Definition date: | 2017-04-18 | Last modified: | 2020-07-17 | Release date: | 2017-10-18 | Identifier: | 2-{[(2E)-but-2-enoyl]amino}-2-deoxy-beta-D-glucopyranose |
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