 | | 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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 | | KBA | | Name: | 2-(1H-1,2,3-triazol-1-yl)ethyl 6-deoxy-alpha-L-galactopyranoside | | Formula: | C10 H17 N3 O5 | | SMILES: | C[CH]1O[CH](OCCn2ccnn2)[CH](O)[CH](O)[CH]1O | | InChi: | InChI=1S/C10H17N3O5/c1-6-7(14)8(15)9(16)10(18-6)17-5-4-13-3-2-11-12-13/h2-3,6-10,14-16H,4-5H2,1H3/t6-,7+,8+,9-,10+/m0/s1 | | Synonyms: | (2~{S},3~{S},4~{R},5~{S},6~{R})-2-methyl-6-[2-(1,2,3-triazol-1-yl)ethoxy]oxane-3,4,5-triol | | Definition date: | 2018-06-28 | | Last modified: | 2020-07-17 | | Release date: | 2018-08-22 | | Identifier: | (2~{S},3~{S},4~{R},5~{S},6~{R})-2-methyl-6-[2-(1,2,3-triazol-1-yl)ethoxy]oxane-3,4,5-triol |
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 | | KBG | | Name: | beta-D-arabino-hexopyranos-2-ulose | | Formula: | C6 H10 O6 | | SMILES: | O=C1C(O)OC(CO)C(O)C1O | | InChi: | InChI=1S/C6H10O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-4,6-9,11H,1H2/t2-,3-,4+,6-/m1/s1 | | Synonyms: | 2-KETO-BETA-D-GLUCOSE | | Definition date: | 2006-01-09 | | Last modified: | 2020-07-17 | | Identifier: | beta-D-arabino-hexopyranos-2-ulose |
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 | | KD5 | | Name: | 4,7-anhydro-3-deoxy-D-manno-oct-2-ulosonic acid | | Formula: | C8 H12 O7 | | SMILES: | O=C(O)C(=O)CC1OC(CO)C(O)C1O | | InChi: | InChI=1S/C8H12O7/c9-2-5-7(12)6(11)4(15-5)1-3(10)8(13)14/h4-7,9,11-12H,1-2H2,(H,13,14)/t4?,5-,6-,7-/m1/s1 | | Definition date: | 2012-03-22 | | Last modified: | 2020-07-17 | | Release date: | 2013-03-27 | | Identifier: | 4,7-anhydro-3-deoxy-D-manno-oct-2-ulosonic acid |
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 | | KDA | | Name: | prop-2-en-1-yl 3-deoxy-alpha-D-manno-oct-2-ulopyranosidonic acid | | Formula: | C11 H18 O8 | | SMILES: | O=C(O)C1(OCC=C)OC(C(O)CO)C(O)C(O)C1 | | InChi: | InChI=1S/C11H18O8/c1-2-3-18-11(10(16)17)4-6(13)8(15)9(19-11)7(14)5-12/h2,6-9,12-15H,1,3-5H2,(H,16,17)/t6-,7-,8-,9-,11-/m1/s1 | | Synonyms: | (3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-2-O-ALLYL | | Definition date: | 2003-09-15 | | Last modified: | 2020-07-17 | | Identifier: | prop-2-en-1-yl 3-deoxy-alpha-D-manno-oct-2-ulopyranosidonic acid |
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 | | KDB | | Name: | 3,4,5-trideoxy-alpha-D-erythro-oct-3-en-2-ulopyranosonic acid | | Formula: | C8 H12 O6 | | SMILES: | OC1(C(=O)O)C=CCC(C(CO)O)O1 | | InChi: | InChI=1S/C8H12O6/c9-4-5(10)6-2-1-3-8(13,14-6)7(11)12/h1,3,5-6,9-10,13H,2,4H2,(H,11,12)/t5-,6+,8-/m1/s1 | | Synonyms: | 3,4-dehydro-3,4,5-trideoxy-alpha-D-manno-oct-2-ulosonic acid | | Definition date: | 2008-01-04 | | Last modified: | 2020-07-17 | | Identifier: | 3,4,5-trideoxy-alpha-D-erythro-oct-3-en-2-ulopyranosonic acid |
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 | | KDD | | Name: | 2,6-anhydro-3,5-dideoxy-D-ribo-oct-2-enonic acid | | Formula: | C8 H12 O6 | | SMILES: | OC[CH](O)[CH]1C[CH](O)C=C(O1)C(O)=O | | InChi: | InChI=1S/C8H12O6/c9-3-5(11)6-1-4(10)2-7(14-6)8(12)13/h2,4-6,9-11H,1,3H2,(H,12,13)/t4-,5-,6+/m1/s1 | | Synonyms: | 5-deoxy-4-epi-2,3-dehydro-alpha-D-manno-oct-2-ulosonic acid | | Definition date: | 2008-01-11 | | Last modified: | 2020-07-17 | | Identifier: | (2~{S})-2-[(1~{R})-1,2-bis(oxidanyl)ethyl]-4-oxidanyl-3,4-dihydro-2~{H}-pyran-6-carboxylic acid |
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 | | KDE | | Name: | prop-2-en-1-yl 3-deoxy-beta-L-gulo-oct-2-ulopyranosidonic acid | | Formula: | C11 H18 O8 | | SMILES: | O=C(O)C1(OCC=C)OC(C(O)CO)C(O)C(O)C1 | | InChi: | InChI=1S/C11H18O8/c1-2-3-18-11(10(16)17)4-6(13)8(15)9(19-11)7(14)5-12/h2,6-9,12-15H,1,3-5H2,(H,16,17)/t6-,7+,8-,9-,11-/m1/s1 | | Synonyms: | ALPHA-7-EPI-(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-2-O-ALLYL | | Definition date: | 2008-01-18 | | Last modified: | 2020-07-17 | | Identifier: | prop-2-en-1-yl 3-deoxy-beta-L-gulo-oct-2-ulopyranosidonic acid |
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 | | KDF | | Name: | 3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acid | | Formula: | C6 H10 O6 | | SMILES: | O=C(O)C1(O)OC(CO)C(O)C1 | | InChi: | InChI=1S/C6H10O6/c7-2-4-3(8)1-6(11,12-4)5(9)10/h3-4,7-8,11H,1-2H2,(H,9,10)/t3-,4+,6+/m0/s1 | | Synonyms: | 2-keto-3-deoxygluconate | | Definition date: | 2007-09-04 | | Last modified: | 2020-07-17 | | Identifier: | 3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acid |
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 | | KDM | | Name: | deamino-alpha-neuraminic acid | | Formula: | C9 H16 O9 | | SMILES: | OC[CH](O)[CH](O)[CH]1O[C](O)(C[CH](O)[CH]1O)C(O)=O | | InChi: | InChI=1S/C9H16O9/c10-2-4(12)6(14)7-5(13)3(11)1-9(17,18-7)8(15)16/h3-7,10-14,17H,1-2H2,(H,15,16)/t3-,4+,5+,6+,7+,9+/m0/s1 | | Synonyms: | alpha-deaminoneuraminic acid | | Definition date: | 2010-11-26 | | Last modified: | 2020-07-17 | | Identifier: | (2R,4S,5R,6R)-2,4,5-trihydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid |
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 | | KDN | | Name: | deamino-beta-neuraminic acid | | Formula: | C9 H16 O9 | | SMILES: | O=C(O)C1(O)OC(C(O)C(O)CO)C(O)C(O)C1 | | InChi: | InChI=1S/C9H16O9/c10-2-4(12)6(14)7-5(13)3(11)1-9(17,18-7)8(15)16/h3-7,10-14,17H,1-2H2,(H,15,16)/t3-,4+,5+,6+,7+,9-/m0/s1 | | Synonyms: | beta-deaminoneuraminic acid | | Definition date: | 2008-09-18 | | Last modified: | 2020-07-17 | | Identifier: | 3-deoxy-D-glycero-beta-D-galacto-non-2-ulopyranosonic acid |
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 | | KDO | | Name: | 3-deoxy-alpha-D-manno-oct-2-ulopyranosonic acid | | Formula: | C8 H14 O8 | | SMILES: | O=C(O)C1(O)OC(C(O)CO)C(O)C(O)C1 | | InChi: | InChI=1S/C8H14O8/c9-2-4(11)6-5(12)3(10)1-8(15,16-6)7(13)14/h3-6,9-12,15H,1-2H2,(H,13,14)/t3-,4-,5-,6-,8-/m1/s1 | | Synonyms: | 3-deoxy-d-manno-oct-2-ulopyranosonic acid | | Definition date: | 1999-07-08 | | Last modified: | 2020-07-17 | | Identifier: | 3-deoxy-alpha-D-manno-oct-2-ulopyranosonic acid |
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 | | KDR | | Name: | prop-2-en-1-yl 3-deoxy-alpha-D-manno-octos-2-ulopyranoside | | Formula: | C11 H18 O7 | | SMILES: | O=CC1(OCC=C)OC(C(O)CO)C(O)C(O)C1 | | InChi: | InChI=1S/C11H18O7/c1-2-3-17-11(6-13)4-7(14)9(16)10(18-11)8(15)5-12/h2,6-10,12,14-16H,1,3-5H2/t7-,8-,9-,10-,11-/m1/s1 | | Synonyms: | prop-2-en-1-yl 3-deoxy-alpha-D-manno-octos-2-uloside | | Definition date: | 2008-01-14 | | Last modified: | 2020-07-17 | | Identifier: | prop-2-en-1-yl 3-deoxy-alpha-D-manno-octos-2-ulopyranoside |
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 | | 5DI | | Name: | alpha-D-threo-hexo-2,5-diulo-2,6-pyranosyl fluoride | | Formula: | C6 H9 F O5 | | SMILES: | O=C1C(O)C(O)C(F)(OC1)CO | | InChi: | InChI=1S/C6H9FO5/c7-6(2-8)5(11)4(10)3(9)1-12-6/h4-5,8,10-11H,1-2H2/t4-,5+,6+/m1/s1 | | Synonyms: | 2-OXO-1,2,DIDEOXY-5F-D-IDOPYRANOSE | | Definition date: | 2012-03-14 | | Last modified: | 2020-07-17 | | Release date: | 2013-03-27 | | Identifier: | alpha-D-threo-hexo-2,5-diulo-2,6-pyranosyl fluoride |
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 | | 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 |
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 | | 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 |
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 | | 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 |
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 | | 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 |
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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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 | | 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 |
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 | | 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 |
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 | | 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 |
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 | | 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 |
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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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