| TFU | Name: | methyl 1-seleno-beta-L-fucopyranoside | Formula: | C7 H14 O4 Se | SMILES: | C[Se][CH]1O[CH](C)[CH](O)[CH](O)[CH]1O | InChi: | InChI=1S/C7H14O4Se/c1-3-4(8)5(9)6(10)7(11-3)12-2/h3-10H,1-2H3/t3-,4+,5+,6-,7+/m0/s1 | Synonyms: | (2S,3S,4R,5S,6R)-2-methyl-6-methylselanyl-oxane-3,4,5-triol | Definition date: | 2015-11-12 | Last modified: | 2020-07-17 | Release date: | 2016-06-29 | Identifier: | (2~{S},3~{S},4~{R},5~{S},6~{R})-2-methyl-6-methylselanyl-oxane-3,4,5-triol |
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| D1M | Name: | 5-ethynyl-1-(beta-D-glucopyranosyl)pyrimidine-2,4(1H,3H)-dione | Formula: | C12 H14 N2 O7 | SMILES: | O=C1NC(=O)N(C=C1C#C)C2OC(C(O)C(O)C2O)CO | InChi: | InChI=1S/C12H14N2O7/c1-2-5-3-14(12(20)13-10(5)19)11-9(18)8(17)7(16)6(4-15)21-11/h1,3,6-9,11,15-18H,4H2,(H,13,19,20)/t6-,7-,8+,9-,11-/m1/s1 | Synonyms: | 5-ethynyl-1-(beta-D-glucosyl)pyrimidine-2,4(1H,3H)-dione | Definition date: | 2012-04-12 | Last modified: | 2020-07-17 | Identifier: | 5-ethynyl-1-(beta-D-glucopyranosyl)pyrimidine-2,4(1H,3H)-dione |
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| TGA | Name: | 2-sulfanylethyl beta-D-galactopyranoside | Formula: | C8 H16 O6 S | SMILES: | OC[CH]1O[CH](OCCS)[CH](O)[CH](O)[CH]1O | InChi: | InChI=1S/C8H16O6S/c9-3-4-5(10)6(11)7(12)8(14-4)13-1-2-15/h4-12,15H,1-3H2/t4-,5+,6+,7-,8-/m1/s1 | Synonyms: | METHANETHIOSULFONYL-GALACTOSIDE | Definition date: | 2011-01-19 | Last modified: | 2020-07-17 | Identifier: | (2R,3R,4S,5R,6R)-2-(hydroxymethyl)-6-(2-sulfanylethoxy)oxane-3,4,5-triol |
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| TGK | Name: | 1-deoxy-beta-L-tagatopyranose | Formula: | C6 H12 O5 | SMILES: | C1(C(C(C(CO1)O)O)O)(C)O | InChi: | InChI=1S/C6H12O5/c1-6(10)5(9)4(8)3(7)2-11-6/h3-5,7-10H,2H2,1H3/t3-,4+,5+,6-/m0/s1 | Synonyms: | 1-deoxy-beta-L-tagatose | Definition date: | 2015-03-27 | Last modified: | 2020-07-17 | Release date: | 2016-03-23 | Identifier: | 1-deoxy-beta-L-tagatopyranose |
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| TGR | Name: | 1-deoxy-alpha-D-xylo-hex-3-ulofuranose | Formula: | C6 H12 O5 | SMILES: | CC(C1(OCC(C1O)O)O)O | InChi: | InChI=1S/C6H12O5/c1-3(7)6(10)5(9)4(8)2-11-6/h3-5,7-10H,2H2,1H3/t3-,4+,5-,6-/m0/s1 | Synonyms: | 1-deoxy 3-keto D-galactitol(Furanose form) | Definition date: | 2015-03-27 | Last modified: | 2020-07-17 | Release date: | 2016-03-23 | Identifier: | 1-deoxy-alpha-D-xylo-hex-3-ulofuranose |
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| PDX | Name: | 2,3-di-O-sulfo-alpha-D-glucopyranose | Formula: | C6 H12 O12 S2 | SMILES: | O=S(=O)(O)OC1C(O)C(OC(O)C1OS(=O)(=O)O)CO | InChi: | InChI=1S/C6H12O12S2/c7-1-2-3(8)4(17-19(10,11)12)5(6(9)16-2)18-20(13,14)15/h2-9H,1H2,(H,10,11,12)(H,13,14,15)/t2-,3-,4+,5-,6+/m1/s1 | Synonyms: | 2,3-di-O-sulfo-alpha-D-glucose | Definition date: | 2002-10-23 | Last modified: | 2020-07-17 | Identifier: | 2,3-di-O-sulfo-alpha-D-glucopyranose |
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| 17T | Name: | N-({(2E)-2-[(4-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/c2ccc(Cl)cc2 | InChi: | InChI=1S/C14H18ClN3O5S/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: | N-({(2E)-2-[(4-chlorophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucosylamine | Definition date: | 2010-05-03 | Last modified: | 2020-07-17 | Identifier: | N-{[(2E)-2-(4-chlorobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine |
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| TGY | Name: | 1-deoxy-alpha-D-tagatopyranose | Formula: | C6 H12 O5 | SMILES: | C1(O)C(O)C(C(O)(C)OC1)O | InChi: | InChI=1S/C6H12O5/c1-6(10)5(9)4(8)3(7)2-11-6/h3-5,7-10H,2H2,1H3/t3-,4+,5+,6+/m1/s1 | Synonyms: | 1-deoxy-alpha-D-tagatose | Definition date: | 2015-03-26 | Last modified: | 2020-07-17 | Release date: | 2016-03-23 | Identifier: | 1-deoxy-alpha-D-tagatopyranose |
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| TH1 | Name: | (1R)-1,5-anhydro-1-(5-methyl-1,3-benzothiazol-2-yl)-D-glucitol | Formula: | C14 H17 N O5 S | SMILES: | n1c3cc(ccc3sc1C2OC(CO)C(O)C(O)C2O)C | InChi: | InChI=1S/C14H17NO5S/c1-6-2-3-9-7(4-6)15-14(21-9)13-12(19)11(18)10(17)8(5-16)20-13/h2-4,8,10-13,16-19H,5H2,1H3/t8-,10-,11+,12-,13-/m1/s1 | Synonyms: | 2-(BETA-D-GLUCOPYRANOSYL)-5-METHYL-BENZOTHIAZOLE | Definition date: | 2004-10-05 | Last modified: | 2020-07-17 | Identifier: | (1R)-1,5-anhydro-1-(5-methyl-1,3-benzothiazol-2-yl)-D-glucitol |
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| 18D | Name: | 3,5-dideoxy-5-(propanoylamino)-D-glycero-alpha-D-galacto-non-2-ulopyranosonic acid | Formula: | C12 H21 N O9 | SMILES: | O=C(O)C1(O)OC(C(O)C(O)CO)C(NC(=O)CC)C(O)C1 | InChi: | InChI=1S/C12H21NO9/c1-2-7(17)13-8-5(15)3-12(21,11(19)20)22-10(8)9(18)6(16)4-14/h5-6,8-10,14-16,18,21H,2-4H2,1H3,(H,13,17)(H,19,20)/t5-,6+,8+,9+,10+,12+/m0/s1 | Synonyms: | 3,5-dideoxy-5-(propanoylamino)-D-glycero-alpha-D-galacto-non-2-ulosonic acid | Definition date: | 2009-04-27 | Last modified: | 2020-07-17 | Identifier: | 3,5-dideoxy-5-(propanoylamino)-D-glycero-alpha-D-galacto-non-2-ulopyranosonic acid |
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| 18O | Name: | N-({(2E)-2-[(4-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=C/c2ccc([N+]([O-])=O)cc2 | InChi: | InChI=1S/C14H18N4O7S/c19-6-9-10(20)11(21)12(22)13(25-9)16-14(26)17-15-5-7-1-3-8(4-2-7)18(23)24/h1-5,9-13,19-22H,6H2,(H2,16,17,26)/b15-5+/t9-,10-,11+,12-,13-/m1/s1 | Synonyms: | 4-nitrobenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone | Definition date: | 2010-05-03 | Last modified: | 2020-07-17 | Identifier: | N-{[(2E)-2-(4-nitrobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine |
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| 95Z | Name: | 2-amino-2-deoxy-alpha-D-mannopyranose | Formula: | C6 H13 N O5 | SMILES: | N[CH]1[CH](O)O[CH](CO)[CH](O)[CH]1O | InChi: | InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3+,4-,5-,6+/m1/s1 | Synonyms: | alpha-D-mannosamine | Definition date: | 2017-04-25 | Last modified: | 2020-07-17 | Release date: | 2017-12-27 | Identifier: | (2~{S},3~{S},4~{R},5~{S},6~{R})-3-azanyl-6-(hydroxymethyl)oxane-2,4,5-triol |
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| D5E | Name: | paromamine | Formula: | C12 H25 N3 O7 | SMILES: | N[CH]1C[CH](N)[CH](O[CH]2O[CH](CO)[CH](O)[CH](O)[CH]2N)[CH](O)[CH]1O | InChi: | InChI=1S/C12H25N3O7/c13-3-1-4(14)11(10(20)7(3)17)22-12-6(15)9(19)8(18)5(2-16)21-12/h3-12,16-20H,1-2,13-15H2/t3-,4+,5-,6-,7+,8-,9-,10-,11-,12-/m1/s1 | Definition date: | 2017-12-21 | Last modified: | 2020-07-17 | Release date: | 2018-01-17 | Identifier: | (2~{R},3~{S},4~{R},5~{R},6~{S})-5-azanyl-6-[(1~{R},2~{R},3~{S},4~{R},6~{S})-4,6-bis(azanyl)-2,3-bis(oxidanyl)cyclohexyl
]oxy-2-(hydroxymethyl)oxane-3,4-diol |
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| PH5 | Name: | benzyl 3,5-dideoxy-5-(propanoylamino)-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid | Formula: | C19 H27 N O9 | SMILES: | O=C(O)C2(OCc1ccccc1)OC(C(O)C(O)CO)C(NC(=O)CC)C(O)C2 | InChi: | InChI=1S/C19H27NO9/c1-2-14(24)20-15-12(22)8-19(18(26)27,28-10-11-6-4-3-5-7-11)29-17(15)16(25)13(23)9-21/h3-7,12-13,15-17,21-23,25H,2,8-10H2,1H3,(H,20,24)(H,26,27)/t12-,13+,15+,16+,17+,19+/m0/s1 | Synonyms: | 2-PHENYL-PROP5AC | Definition date: | 2005-06-27 | Last modified: | 2020-07-17 | Identifier: | benzyl 3,5-dideoxy-5-(propanoylamino)-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid |
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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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| D6G | Name: | 2-deoxy-6-O-phosphono-alpha-D-glucopyranose | Formula: | C6 H13 O8 P | SMILES: | O=P(O)(O)OCC1OC(O)CC(O)C1O | InChi: | InChI=1S/C6H13O8P/c7-3-1-5(8)14-4(6(3)9)2-13-15(10,11)12/h3-9H,1-2H2,(H2,10,11,12)/t3-,4-,5+,6+/m1/s1 | Synonyms: | 2-deoxy-6-O-phosphono-alpha-D-arabino-hexopyranose | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | 2-deoxy-6-O-phosphono-alpha-D-arabino-hexopyranose |
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| 1CF | Name: | 2-hydroxyethyl 6-deoxy-beta-L-galactopyranoside | Formula: | C8 H16 O6 | SMILES: | O(CCO)C1OC(C(O)C(O)C1O)C | InChi: | InChI=1S/C8H16O6/c1-4-5(10)6(11)7(12)8(14-4)13-3-2-9/h4-12H,2-3H2,1H3/t4-,5+,6+,7-,8-/m0/s1 | Synonyms: | 2-hydroxyethyl 6-deoxy-beta-L-galactoside | Definition date: | 2012-12-04 | Last modified: | 2020-07-17 | Release date: | 2014-01-29 | Identifier: | 2-hydroxyethyl 6-deoxy-beta-L-galactopyranoside |
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| TMR | Name: | 2,6-dideoxy-4-S-methyl-4-thio-beta-D-ribo-hexopyranose | Formula: | C7 H14 O3 S | SMILES: | S(C1C(OC(O)CC1O)C)C | InChi: | InChI=1S/C7H14O3S/c1-4-7(11-2)5(8)3-6(9)10-4/h4-9H,3H2,1-2H3/t4-,5+,6-,7-/m1/s1 | Synonyms: | 2,6-DIDEOXY-4-THIOMETHYL-BETA-D-RIBOHEXOPYRANOSIDE | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | 2,6-dideoxy-4-S-methyl-4-thio-beta-D-ribo-hexopyranose |
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| TMX | Name: | 2-deoxy-2-(trimethylammonio)-beta-D-glucopyranose | Formula: | C9 H20 N O5 | SMILES: | OC1OC(C(O)C(O)C1[N+](C)(C)C)CO | InChi: | InChI=1S/C9H20NO5/c1-10(2,3)6-8(13)7(12)5(4-11)15-9(6)14/h5-9,11-14H,4H2,1-3H3/q+1/t5-,6-,7-,8-,9-/m1/s1 | Synonyms: | 2-deoxy-2-(trimethylammonio)-beta-D-glucose | Definition date: | 2010-09-02 | Last modified: | 2020-07-17 | Identifier: | 2-deoxy-2-(trimethylammonio)-beta-D-glucopyranose |
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| PKM | Name: | 4-O-acetyl-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosonic acid | Formula: | C13 H21 N O10 | SMILES: | C(=O)(O)C1(O)CC(OC(=O)C)C(C(O1)C(C(O)CO)O)NC(C)=O | InChi: | InChI=1S/C13H21NO10/c1-5(16)14-9-8(23-6(2)17)3-13(22,12(20)21)24-11(9)10(19)7(18)4-15/h7-11,15,18-19,22H,3-4H2,1-2H3,(H,14,16)(H,20,21)/t7-,8+,9-,10-,11-,13-/m1/s1 | Synonyms: | 4-O-acetyl-5-(acetylamino)-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosonic acid | Definition date: | 2019-08-14 | Last modified: | 2020-07-17 | Release date: | 2020-02-12 | Identifier: | 4-O-acetyl-5-(acetylamino)-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosonic acid |
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| TNX | Name: | 1,5-anhydro-2-deoxy-2-(ethanethioylamino)-D-arabino-hex-1-enitol | Formula: | C8 H13 N O4 S | SMILES: | C=1OC(C(C(C=1NC(=S)C)O)O)CO | InChi: | InChI=1S/C8H13NO4S/c1-4(14)9-5-3-13-6(2-10)8(12)7(5)11/h3,6-8,10-12H,2H2,1H3,(H,9,14)/t6-,7-,8-/m1/s1 | Synonyms: | N-[(2R,3S,4R)-2-(hydroxymethyl)-3,4-bis(oxidanyl)-3,4-dihydro-2H-pyran-5-yl]ethanethioamide | Definition date: | 2015-12-18 | Last modified: | 2020-07-17 | Release date: | 2016-10-26 | Identifier: | 1,5-anhydro-2-deoxy-2-(ethanethioylamino)-D-arabino-hex-1-enitol |
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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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| TOA | Name: | 3-ammonio-3-deoxy-alpha-D-glucopyranose | Formula: | C6 H14 N O5 | SMILES: | OC1C([NH3+])C(O)C(OC1O)CO | InChi: | InChI=1S/C6H13NO5/c7-3-4(9)2(1-8)12-6(11)5(3)10/h2-6,8-11H,1,7H2/p+1/t2-,3+,4-,5-,6+/m1/s1 | Synonyms: | 3-DEOXY-3-AMINO GLUCOSE | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | 3-ammonio-3-deoxy-alpha-D-glucopyranose |
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| TOC | Name: | 2,6-diammonio-2,3,6-trideoxy-alpha-D-glucopyranose | Formula: | C6 H16 N2 O3 | SMILES: | OC1C(OC(O)C([NH3+])C1)C[NH3+] | InChi: | InChI=1S/C6H14N2O3/c7-2-5-4(9)1-3(8)6(10)11-5/h3-6,9-10H,1-2,7-8H2/p+2/t3-,4+,5-,6+/m1/s1 | Synonyms: | 2,3,6-TRIDEOXY-2,6-DIAMINO GLUCOSE | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | 2,6-diammonio-2,3,6-trideoxy-alpha-D-ribo-hexopyranose |
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| DAF | Name: | 4,6-dideoxy-4-{[(1S,5R,6S)-3-formyl-5,6-dihydroxy-4-oxocyclohex-2-en-1-yl]amino}-alpha-D-xylo-hex-5-enopyranose | Formula: | C13 H17 N O8 | SMILES: | O=CC2=CC(NC1C(/OC(O)C(O)C1O)=C)C(O)C(O)C2=O | InChi: | InChI=1S/C13H17NO8/c1-4-7(10(18)12(20)13(21)22-4)14-6-2-5(3-15)8(16)11(19)9(6)17/h2-3,6-7,9-14,17-21H,1H2/t6-,7+,9-,10-,11-,12+,13-/m0/s1 | Synonyms: | 4,6-dideoxy-4-{[(1S,5R,6S)-3-formyl-5,6-dihydroxy-4-oxocyclohex-2-en-1-yl]amino}-alpha-D-xylo-hex-5-enose | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | 4,6-dideoxy-4-{[(1S,5R,6S)-3-formyl-5,6-dihydroxy-4-oxocyclohex-2-en-1-yl]amino}-alpha-D-xylo-hex-5-enopyranose |
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