 | | 9PG | | Name: | 4-nitrophenyl alpha-D-galactopyranoside | | Formula: | C12 H15 N O8 | | SMILES: | C(C1OC(C(C(C1O)O)O)Oc2ccc([N+]([O-])=O)cc2)O | | 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-galactoside | | Definition date: | 2015-05-22 | | Last modified: | 2020-07-17 | | Release date: | 2015-07-29 | | Identifier: | 4-nitrophenyl alpha-D-galactopyranoside |
|
 | | 9QG | | Name: | methyl 3-O-[(1R)-1-carboxyethyl]-beta-D-galactopyranoside | | Formula: | C10 H18 O8 | | SMILES: | O(C)C1OC(CO)C(C(C1O)OC(C(O)=O)C)O | | InChi: | InChI=1S/C10H18O8/c1-4(9(14)15)17-8-6(12)5(3-11)18-10(16-2)7(8)13/h4-8,10-13H,3H2,1-2H3,(H,14,15)/t4-,5-,6+,7-,8+,10-/m1/s1 | | Synonyms: | methyl 3-O-[(1R)-1-carboxyethyl]-beta-D-galactoside | | Definition date: | 2017-05-25 | | Last modified: | 2020-07-17 | | Release date: | 2018-05-23 | | Identifier: | methyl 3-O-[(1R)-1-carboxyethyl]-beta-D-galactopyranoside |
|
 | | C3B | | Name: | 4-amino-1-beta-D-glucopyranosylpyrimidin-2(1H)-one | | Formula: | C10 H15 N3 O6 | | SMILES: | O=C1N=C(N)C=CN1C2OC(C(O)C(O)C2O)CO | | InChi: | InChI=1S/C10H15N3O6/c11-5-1-2-13(10(18)12-5)9-8(17)7(16)6(15)4(3-14)19-9/h1-2,4,6-9,14-17H,3H2,(H2,11,12,18)/t4-,6-,7+,8-,9-/m1/s1 | | Synonyms: | 1-D-glucopyranosyl-cytosine | | Definition date: | 2007-11-16 | | Last modified: | 2020-07-17 | | Identifier: | 4-amino-1-beta-D-glucopyranosylpyrimidin-2(1H)-one |
|
 | | C3G | | Name: | 4-nitrophenyl beta-D-glucopyranosiduronic acid | | Formula: | C12 H13 N O9 | | SMILES: | C(=O)(O)C1C(C(C(C(O1)Oc2ccc([N+](=O)[O-])cc2)O)O)O | | InChi: | InChI=1S/C12H13NO9/c14-7-8(15)10(11(17)18)22-12(9(7)16)21-6-3-1-5(2-4-6)13(19)20/h1-4,7-10,12,14-16H,(H,17,18)/t7-,8-,9+,10-,12+/m0/s1 | | Synonyms: | 4-nitrophenyl beta-D-glucosiduronic acid | | Definition date: | 2017-09-11 | | Last modified: | 2020-07-17 | | Release date: | 2017-12-20 | | Identifier: | 4-nitrophenyl beta-D-glucopyranosiduronic acid |
|
 | | C3X | | Name: | (2R)-oxiran-2-ylmethyl beta-D-xylopyranoside | | Formula: | C8 H14 O6 | | SMILES: | O(CC1OC1)C2OCC(O)C(O)C2O | | InChi: | InChI=1S/C8H14O6/c9-5-3-14-8(7(11)6(5)10)13-2-4-1-12-4/h4-11H,1-3H2/t4-,5-,6+,7-,8-/m1/s1 | | Synonyms: | 2,3-EPOXYPROPYL-BETA-D-XYLOSIDE | | Definition date: | 1999-07-08 | | Last modified: | 2020-07-17 | | Identifier: | (2R)-oxiran-2-ylmethyl beta-D-xylopyranoside |
|
 | | C4B | | Name: | 1-beta-D-glucopyranosyl-1,3,5-triazinane-2,4,6-trione | | Formula: | C9 H13 N3 O8 | | SMILES: | O=C1N(C(=O)NC(=O)N1)C2OC(C(O)C(O)C2O)CO | | InChi: | InChI=1S/C9H13N3O8/c13-1-2-3(14)4(15)5(16)6(20-2)12-8(18)10-7(17)11-9(12)19/h2-6,13-16H,1H2,(H2,10,11,17,18,19)/t2-,3-,4+,5-,6-/m1/s1 | | Synonyms: | 1-beta-D-glucosyl-1,3,5-triazinane-2,4,6-trione | | Definition date: | 2007-11-18 | | Last modified: | 2020-07-17 | | Identifier: | 1-beta-D-glucopyranosyl-1,3,5-triazinane-2,4,6-trione |
|
 | | 9SG | | Name: | (2R,3R,5R,6R)-5-acetamido-2,3-bis(fluoranyl)-6-[(1R,2R)-1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic acid | | Formula: | C11 H17 F2 N O7 | | SMILES: | O=C(C)NC1C(C(C(CO)O)O)OC(C(C1)F)(F)C(=O)O | | InChi: | InChI=1S/C11H17F2NO7/c1-4(16)14-5-2-7(12)11(13,10(19)20)21-9(5)8(18)6(17)3-15/h5-9,15,17-18H,2-3H2,1H3,(H,14,16)(H,19,20)/t5-,6-,7-,8-,9-,11-/m1/s1 | | Synonyms: | (2~{R},3~{R},5~{R},6~{R})-5-acetamido-2,3-bis(fluoranyl)-6-[(1~{R},2~{R})-1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic
acid | | Definition date: | 2017-06-07 | | Last modified: | 2020-07-17 | | Release date: | 2018-02-21 | | Identifier: | (2R,3R,5R,6R)-5-(acetylamino)-2,3-difluoro-6-[(1R,2R)-1,2,3-trihydroxypropyl]tetrahydro-2H-pyran-2-carboxylic acid
(non-preferred name) |
|
 | | C4W | | Name: | 1-azido-beta-N-acetyl-D-glucosamine | | Formula: | C8 H14 N4 O5 | | SMILES: | CC(=O)N[CH]1[CH](O)[CH](O)[CH](CO)O[CH]1N=[N+]=[N-] | | InChi: | InChI=1S/C8H14N4O5/c1-3(14)10-5-7(16)6(15)4(2-13)17-8(5)11-12-9/h4-8,13,15-16H,2H2,1H3,(H,10,14)/t4-,5-,6-,7-,8-/m1/s1 | | Definition date: | 2017-11-13 | | Last modified: | 2020-07-17 | | Release date: | 2018-07-11 | | Identifier: | ~{N}-[(2~{R},3~{R},4~{R},5~{S},6~{R})-2-azido-6-(hydroxymethyl)-4,5-bis(oxidanyl)oxan-3-yl]ethanamide |
|
 | | 9SM | | Name: | (2R,3R,4R,5R,6S)-5-acetamido-6-[(2S)-2,3-bis(oxidanyl)propyl]-2,3-bis(fluoranyl)-4-oxidanyl-oxane-2-carboxylic acid | | Formula: | C11 H17 F2 N O7 | | SMILES: | OC(C1(OC(CC(CO)O)C(C(C1F)O)NC(=O)C)F)=O | | InChi: | InChI=1S/C11H17F2NO7/c1-4(16)14-7-6(2-5(17)3-15)21-11(13,10(19)20)9(12)8(7)18/h5-9,15,17-18H,2-3H2,1H3,(H,14,16)(H,19,20)/t5-,6-,7-,8+,9+,11+/m0/s1 | | Synonyms: | (2~{R},3~{R},4~{R},5~{R},6~{S})-5-acetamido-6-[(2~{S})-2,3-bis(oxidanyl)propyl]-2,3-bis(fluoranyl)-4-oxidanyl-oxane-2-c
arboxylic acid | | Definition date: | 2017-06-07 | | Last modified: | 2020-07-17 | | Release date: | 2018-02-21 | | Identifier: | (2R,3R,4R,5R,6S)-5-(acetylamino)-6-[(2S)-2,3-dihydroxypropyl]-2,3-difluoro-4-hydroxytetrahydro-2H-pyran-2-carboxylic
acid (non-preferred name) |
|
 | | 9SP | | Name: | (2R,3R,4R,5R,6R)-5-acetamido-6-[(1R)-1,3-bis(oxidanyl)propyl]-2,3-bis(fluoranyl)-4-oxidanyl-oxane-2-carboxylic acid | | Formula: | C11 H17 F2 N O7 | | SMILES: | OC(C1(OC(C(O)CCO)C(C(C1F)O)NC(=O)C)F)=O | | InChi: | InChI=1S/C11H17F2NO7/c1-4(16)14-6-7(18)9(12)11(13,10(19)20)21-8(6)5(17)2-3-15/h5-9,15,17-18H,2-3H2,1H3,(H,14,16)(H,19,20)/t5-,6-,7-,8+,9-,11-/m1/s1 | | Synonyms: | (2~{R},3~{R},4~{R},5~{R},6~{R})-5-acetamido-6-[(1~{R})-1,3-bis(oxidanyl)propyl]-2,3-bis(fluoranyl)-4-oxidanyl-oxane-2-c
arboxylic acid | | Definition date: | 2017-06-07 | | Last modified: | 2020-07-17 | | Release date: | 2018-02-21 | | Identifier: | (2R,3R,4R,5R,6R)-5-(acetylamino)-6-[(1R)-1,3-dihydroxypropyl]-2,3-difluoro-4-hydroxytetrahydro-2H-pyran-2-carboxylic
acid (non-preferred name) |
|
 | | 9T7 | | Name: | (2R,3R,4R,5R,6R)-5-acetamido-6-[(1R,2R)-1,2-bis(oxidanyl)propyl]-2,3-bis(fluoranyl)-4-oxidanyl-oxane-2-carboxylic acid | | Formula: | C11 H17 F2 N O7 | | SMILES: | OC(C1(OC(C(C(C)O)O)C(C(C1F)O)NC(=O)C)F)=O | | InChi: | InChI=1S/C11H17F2NO7/c1-3(15)6(17)8-5(14-4(2)16)7(18)9(12)11(13,21-8)10(19)20/h3,5-9,15,17-18H,1-2H3,(H,14,16)(H,19,20)/t3-,5-,6-,7-,8-,9-,11-/m1/s1 | | Synonyms: | (2~{R},3~{R},4~{R},5~{R},6~{R})-5-acetamido-6-[(1~{R},2~{R})-1,2-bis(oxidanyl)propyl]-2,3-bis(fluoranyl)-4-oxidanyl-oxa
ne-2-carboxylic acid | | Definition date: | 2017-06-07 | | Last modified: | 2020-07-17 | | Release date: | 2018-02-21 | | Identifier: | (2R,3R,4R,5R,6R)-5-(acetylamino)-6-[(1R,2R)-1,2-dihydroxypropyl]-2,3-difluoro-4-hydroxytetrahydro-2H-pyran-2-carboxylic
acid (non-preferred name) |
|
 | | C5X | | Name: | 3-[(2R)-oxiran-2-yl]propyl beta-D-xylopyranoside | | Formula: | C10 H18 O6 | | SMILES: | O(CCCC1OC1)C2OCC(O)C(O)C2O | | InChi: | InChI=1S/C10H18O6/c11-7-5-16-10(9(13)8(7)12)14-3-1-2-6-4-15-6/h6-13H,1-5H2/t6-,7-,8+,9-,10-/m1/s1 | | Synonyms: | 4,5-EPOXYPENTYL-BETA-D-XYLOSIDE | | Definition date: | 1999-07-08 | | Last modified: | 2020-07-17 | | Identifier: | 3-[(2R)-oxiran-2-yl]propyl beta-D-xylopyranoside |
|
 | | B7G | | Name: | heptyl beta-D-glucopyranoside | | 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-BETA-D-GLUCOPYRANOSIDE | | Definition date: | 1999-07-08 | | Last modified: | 2020-07-17 | | Identifier: | heptyl beta-D-glucopyranoside |
|
 | | B8D | | Name: | 4-O-methyl-alpha-D-glucopyranose | | Formula: | C7 H14 O6 | | SMILES: | OC1C(OC)C(OC(O)C1O)CO | | InChi: | InChI=1S/C7H14O6/c1-12-6-3(2-8)13-7(11)5(10)4(6)9/h3-11H,2H2,1H3/t3-,4-,5-,6-,7+/m1/s1 | | Synonyms: | 4-O-methyl-alpha-D-glucose | | Definition date: | 2009-08-18 | | Last modified: | 2020-07-17 | | Identifier: | 4-O-methyl-alpha-D-glucopyranose |
|
 | | BBK | | Name: | 2-acetamido-2-deoxy-5-thio-alpha-D-galactopyranose | | Formula: | C8 H15 N O5 S | | SMILES: | C1(O)C(C(O)C(C(S1)CO)O)NC(C)=O | | 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-alpha-D-galactopyranose | | Definition date: | 2014-04-30 | | Last modified: | 2020-07-17 | | Release date: | 2014-05-28 | | Identifier: | 2-(acetylamino)-2-deoxy-5-thio-alpha-D-galactopyranose |
|
 | | BBV | | Name: | benzyl 2-acetamido-2-deoxy-alpha-D-glucopyranoside | | Formula: | C15 H21 N O6 | | SMILES: | O=C(NC2C(O)C(O)C(OC2OCc1ccccc1)CO)C | | InChi: | InChI=1S/C15H21NO6/c1-9(18)16-12-14(20)13(19)11(7-17)22-15(12)21-8-10-5-3-2-4-6-10/h2-6,11-15,17,19-20H,7-8H2,1H3,(H,16,18)/t11-,12-,13-,14-,15+/m1/s1 | | Synonyms: | benzyl 2-(acetylamino)-2-deoxy-alpha-D-glucopyranoside | | Definition date: | 2012-04-09 | | Last modified: | 2020-07-17 | | Identifier: | benzyl 2-(acetylamino)-2-deoxy-alpha-D-glucopyranoside |
|
 | | BDG | | Name: | 2,6-diamino-2,6-dideoxy-alpha-D-glucopyranose | | Formula: | C6 H14 N2 O4 | | SMILES: | OC1C(O)C(OC(O)C1N)CN | | InChi: | InChI=1S/C6H14N2O4/c7-1-2-4(9)5(10)3(8)6(11)12-2/h2-6,9-11H,1,7-8H2/t2-,3-,4-,5-,6+/m1/s1 | | Synonyms: | O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-D-GLUCOPYRANOSE | | Definition date: | 1999-07-08 | | Last modified: | 2020-07-17 | | Identifier: | 2,6-diamino-2,6-dideoxy-alpha-D-glucopyranose |
|
 | | BDR | | Name: | beta-D-ribofuranose | | Formula: | C5 H10 O5 | | SMILES: | OC1C(OC(O)C1O)CO | | InChi: | InChI=1S/C5H10O5/c6-1-2-3(7)4(8)5(9)10-2/h2-9H,1H2/t2-,3-,4-,5-/m1/s1 | | Synonyms: | beta-D-ribose | | Definition date: | 1999-07-08 | | Last modified: | 2020-07-17 | | Identifier: | beta-D-ribofuranose |
|
 | | BEM | | Name: | beta-D-mannopyranuronic acid | | Formula: | C6 H10 O7 | | SMILES: | O=C(O)C1OC(O)C(O)C(O)C1O | | InChi: | InChI=1S/C6H10O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,6-9,12H,(H,10,11)/t1-,2-,3-,4-,6+/m0/s1 | | Synonyms: | beta-D-mannuronic acid | | Definition date: | 2007-11-05 | | Last modified: | 2020-07-17 | | Identifier: | beta-D-mannopyranuronic acid |
|
 | | 0HX | | Name: | pentan-3-yl 2-acetamido-2,4-dideoxy-alpha-L-threo-hex-4-enopyranosiduronic acid | | Formula: | C13 H21 N O6 | | SMILES: | CCC(CC)O[CH]1OC(=C[CH](O)[CH]1NC(C)=O)C(O)=O | | InChi: | InChI=1S/C13H21NO6/c1-4-8(5-2)19-13-11(14-7(3)15)9(16)6-10(20-13)12(17)18/h6,8-9,11,13,16H,4-5H2,1-3H3,(H,14,15)(H,17,18)/t9-,11+,13+/m0/s1 | | Synonyms: | pentan-3-yl 2-(acetylamino)-2,4-dideoxy-alpha-L-threo-hex-4-enopyranosiduronic acid | | Definition date: | 2012-01-19 | | Last modified: | 2020-07-17 | | Release date: | 2013-02-08 | | Identifier: | (2~{R},3~{R},4~{S})-3-acetamido-4-oxidanyl-2-pentan-3-yloxy-3,4-dihydro-2~{H}-pyran-6-carboxylic acid |
|
 | | BG6 | | Name: | 6-O-phosphono-beta-D-glucopyranose | | 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: | BETA-D-GLUCOSE-6-PHOSPHATE | | Definition date: | 2000-08-29 | | Last modified: | 2020-07-17 | | Identifier: | 6-O-phosphono-beta-D-glucopyranose |
|
 | | BG8 | | Name: | 2-(benzoylamino)-2-deoxy-beta-D-glucopyranose | | Formula: | C13 H17 N O6 | | SMILES: | C2(C(NC(c1ccccc1)=O)C(OC(C2O)CO)O)O | | InChi: | InChI=1S/C13H17NO6/c15-6-8-10(16)11(17)9(13(19)20-8)14-12(18)7-4-2-1-3-5-7/h1-5,8-11,13,15-17,19H,6H2,(H,14,18)/t8-,9-,10-,11-,13-/m1/s1 | | Synonyms: | N-benzoyl-beta-D-glucosamine | | Definition date: | 2015-06-02 | | Last modified: | 2020-07-17 | | Release date: | 2015-06-17 | | Identifier: | 2-(benzoylamino)-2-deoxy-beta-D-glucopyranose |
|
 | | BGL | | Name: | 2-O-octyl-beta-D-glucopyranose | | Formula: | C14 H28 O6 | | SMILES: | O(CCCCCCCC)C1C(O)C(O)C(OC1O)CO | | InChi: | InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-13-12(17)11(16)10(9-15)20-14(13)18/h10-18H,2-9H2,1H3/t10-,11-,12+,13-,14-/m1/s1 | | Synonyms: | 2-O-octyl-beta-D-glucose | | Definition date: | 1999-07-08 | | Last modified: | 2020-07-17 | | Identifier: | 2-O-octyl-beta-D-glucopyranose |
|
 | | BGN | | Name: | 2-(butanoylamino)-2-deoxy-beta-D-glucopyranose | | Formula: | C10 H19 N O6 | | SMILES: | O=C(NC1C(O)C(O)C(OC1O)CO)CCC | | InChi: | InChI=1S/C10H19NO6/c1-2-3-6(13)11-7-9(15)8(14)5(4-12)17-10(7)16/h5,7-10,12,14-16H,2-4H2,1H3,(H,11,13)/t5-,7-,8-,9-,10-/m1/s1 | | Synonyms: | N-BUTANOYL-2-AMINO-2-DEOXY-GLUCOPYRANOSIDE | | Definition date: | 2001-07-31 | | Last modified: | 2020-07-17 | | Identifier: | 2-(butanoylamino)-2-deoxy-beta-D-glucopyranose |
|
 | | BGP | | Name: | 6-O-phosphono-beta-D-galactopyranose | | 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: | BETA-GALACTOSE-6-PHOSPHATE | | Definition date: | 1999-07-08 | | Last modified: | 2020-07-17 | | Identifier: | 6-O-phosphono-beta-D-galactopyranose |
|
