 | | 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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 | | 9GP | | Name: | N-(hydroxyacetyl)-beta-D-glucopyranosylamine | | Formula: | C8 H15 N O7 | | SMILES: | O=C(NC1OC(C(O)C(O)C1O)CO)CO | | InChi: | InChI=1S/C8H15NO7/c10-1-3-5(13)6(14)7(15)8(16-3)9-4(12)2-11/h3,5-8,10-11,13-15H,1-2H2,(H,9,12)/t3-,5-,6+,7-,8-/m1/s1 | | Synonyms: | N-(hydroxyacetyl)-beta-D-glucosylamine | | Definition date: | 2009-02-05 | | Last modified: | 2020-07-17 | | Identifier: | N-(hydroxyacetyl)-beta-D-glucopyranosylamine |
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 | | 9KJ | | Name: | {[(2R,3R,4R,5R)-3-(alpha-D-glucopyranosyloxy)-4-hydroxy-2,5-bis(hydroxymethyl)pyrrolidin-1-yl]methyl}phosphonic acid | | Formula: | C13 H26 N O12 P | | SMILES: | C(C2C(OC1C(O)C(C(C(CO)O1)O)O)C(C(N2CP(=O)(O)O)CO)O)O | | InChi: | InChI=1S/C13H26NO12P/c15-1-5-8(18)12(6(2-16)14(5)4-27(22,23)24)26-13-11(21)10(20)9(19)7(3-17)25-13/h5-13,15-21H,1-4H2,(H2,22,23,24)/t5-,6-,7-,8-,9-,10+,11-,12-,13-/m1/s1 | | Synonyms: | {[(2R,3R,4R,5R)-3-(alpha-D-glucosyloxy)-4-hydroxy-2,5-bis(hydroxymethyl)pyrrolidin-1-yl]methyl}phosphonic acid | | Definition date: | 2017-05-17 | | Last modified: | 2020-07-17 | | Release date: | 2017-06-07 | | Identifier: | {[(2R,3R,4R,5R)-3-(alpha-D-glucopyranosyloxy)-4-hydroxy-2,5-bis(hydroxymethyl)pyrrolidin-1-yl]methyl}phosphonic acid |
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 | | 9MR | | Name: | (3R,4R,5R)-3-hydroxy-5-(hydroxymethyl)piperidin-4-yl beta-D-glucopyranoside | | Formula: | C12 H23 N O8 | | SMILES: | O(C1C(O)CNCC1CO)C2OC(C(O)C(O)C2O)CO | | InChi: | InChI=1S/C12H23NO8/c14-3-5-1-13-2-6(16)11(5)21-12-10(19)9(18)8(17)7(4-15)20-12/h5-19H,1-4H2/t5-,6-,7-,8-,9+,10-,11-,12+/m1/s1 | | Synonyms: | CELLOBIOSE-LIKE ISOFAGOMINE | | Definition date: | 2007-02-26 | | Last modified: | 2020-07-17 | | Identifier: | (3R,4R,5R)-3-hydroxy-5-(hydroxymethyl)piperidin-4-yl beta-D-glucopyranoside |
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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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 | | 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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 | | 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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 | | 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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 | | KTU | | Name: | prop-2-en-1-yl 3,5-dideoxy-alpha-D-threo-oct-5-en-2-ulopyranosidonic acid | | Formula: | C11 H16 O7 | | SMILES: | C=CCOC1(C(O)=O)OC(C(CO)O)=CC(C1)O | | InChi: | InChI=1S/C11H16O7/c1-2-3-17-11(10(15)16)5-7(13)4-9(18-11)8(14)6-12/h2,4,7-8,12-14H,1,3,5-6H2,(H,15,16)/t7-,8+,11+/m0/s1 | | Synonyms: | prop-2-en-1-yl 3,5-dideoxy-alpha-D-threo-oct-5-en-2-ulosidonic acid | | Definition date: | 2012-10-12 | | Last modified: | 2020-07-17 | | Release date: | 2013-01-04 | | Identifier: | prop-2-en-1-yl 3,5-dideoxy-alpha-D-threo-oct-5-en-2-ulopyranosidonic acid |
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 | | 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 |
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 | | 0LP | | Name: | 5-acetamido-2,6-anhydro-3,5-dideoxy-3-[(2E)-3-phenylprop-2-en-1-yl]-D-glycero-L-altro-non-2-enonic acid | | Formula: | C20 H25 N O8 | | SMILES: | CC(=O)NC1C(O)C(=C(OC1C(O)C(O)CO)C(O)=O)C[C@H]=Cc2ccccc2 | | InChi: | InChI=1S/C20H25NO8/c1-11(23)21-15-16(25)13(9-5-8-12-6-3-2-4-7-12)18(20(27)28)29-19(15)17(26)14(24)10-22/h2-8,14-17,19,22,24-26H,9-10H2,1H3,(H,21,23)(H,27,28)/b8-5+/t14-,15-,16+,17+,19-/m1/s1 | | Synonyms: | 5-(acetylamino)-2,6-anhydro-3,5-dideoxy-3-[(2E)-3-phenylprop-2-en-1-yl]-D-glycero-L-altro-non-2-enonic acid | | Definition date: | 2012-08-16 | | Last modified: | 2020-07-17 | | Release date: | 2012-09-21 | | Identifier: | 5-(acetylamino)-2,6-anhydro-3,5-dideoxy-3-[(2E)-3-phenylprop-2-en-1-yl]-D-glycero-L-altro-non-2-enonic acid |
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 | | 0MK | | Name: | beta-L-ribopyranose | | Formula: | C5 H10 O5 | | SMILES: | C1(O)C(O)C(O)C(CO1)O | | 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-ribose | | Definition date: | 2012-03-01 | | Last modified: | 2020-07-17 | | Release date: | 2013-03-20 | | Identifier: | beta-L-ribopyranose |
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 | | JV4 | | Name: | 6-deoxy-6-fluoro-1-O-phosphono-alpha-D-glucopyranose | | Formula: | C6 H12 F O8 P | | SMILES: | C1(C(C(OC(C1O)CF)OP(O)(=O)O)O)O | | InChi: | InChI=1S/C6H12FO8P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-6,8-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1 | | Synonyms: | 6-deoxy-6-fluoro-1-O-phosphono-alpha-D-glucose | | Definition date: | 2018-09-28 | | Last modified: | 2020-07-17 | | Release date: | 2019-07-31 | | Identifier: | 6-deoxy-6-fluoro-1-O-phosphono-alpha-D-glucopyranose |
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 | | JVA | | Name: | 2,6-anhydro-5,7-dideoxy-5-fluoro-7-phosphono-D-glycero-D-manno-heptitol | | Formula: | C7 H14 F O7 P | | SMILES: | C1(OC(C(C(C1F)O)O)CO)CP(O)(O)=O | | InChi: | InChI=1S/C7H14FO7P/c8-5-4(2-16(12,13)14)15-3(1-9)6(10)7(5)11/h3-7,9-11H,1-2H2,(H2,12,13,14)/t3-,4-,5-,6-,7-/m1/s1 | | Definition date: | 2018-10-01 | | Last modified: | 2020-07-17 | | Release date: | 2019-07-31 | | Identifier: | 2,6-anhydro-5,7-dideoxy-5-fluoro-7-phosphono-D-glycero-D-manno-heptitol |
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 | | 0NZ | | Name: | 2-deoxy-6-O-phosphono-beta-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-beta-D-arabino-hexopyranose | | Definition date: | 2012-08-17 | | Last modified: | 2020-07-17 | | Release date: | 2013-06-12 | | Identifier: | 2-deoxy-6-O-phosphono-beta-D-arabino-hexopyranose |
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 | | JVS | | Name: | 1-deoxy-1-fluoro-2-O-phosphono-alpha-D-gluco-hept-2-ulopyranose | | Formula: | C7 H14 F O9 P | | SMILES: | C1(C(C(CF)(OC(C1O)CO)OP(O)(=O)O)O)O | | InChi: | InChI=1S/C7H14FO9P/c8-2-7(17-18(13,14)15)6(12)5(11)4(10)3(1-9)16-7/h3-6,9-12H,1-2H2,(H2,13,14,15)/t3-,4-,5+,6-,7-/m1/s1 | | Synonyms: | 1-deoxy-1-fluoro-2-O-phosphono-alpha-D-gluco-hept-2-ulose | | Definition date: | 2018-10-04 | | Last modified: | 2020-07-17 | | Release date: | 2019-07-31 | | Identifier: | 1-deoxy-1-fluoro-2-O-phosphono-alpha-D-gluco-hept-2-ulopyranose |
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 | | JZR | | Name: | hexyl beta-D-glucopyranoside | | Formula: | C12 H24 O6 | | SMILES: | CCCCCCO[CH]1O[CH](CO)[CH](O)[CH](O)[CH]1O | | InChi: | InChI=1S/C12H24O6/c1-2-3-4-5-6-17-12-11(16)10(15)9(14)8(7-13)18-12/h8-16H,2-7H2,1H3/t8-,9-,10+,11-,12-/m1/s1 | | Synonyms: | hexyl beta-D-glucoside | | Definition date: | 2009-11-11 | | Last modified: | 2020-07-17 | | Identifier: | (2R,3R,4S,5S,6R)-2-hexoxy-6-(hydroxymethyl)oxane-3,4,5-triol |
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 | | K5B | | Name: | 4,7-anhydro-3-deoxy-D-gluco-oct-2-ulosonic acid | | Formula: | C8 H12 O7 | | SMILES: | OC[CH]1O[CH](CC(=O)C(O)=O)[CH](O)[CH]1O | | 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+/m0/s1 | | Synonyms: | 4,7-anhydro-3-deoxy-D-manno-oct-2-ulosonic acid | | Definition date: | 2017-09-07 | | Last modified: | 2020-07-17 | | Release date: | 2018-06-20 | | Identifier: | 3-[(2~{S},3~{S},4~{S},5~{R})-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-2-oxidanylidene-propanoic acid |
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 | | E3M | | Name: | (1R)-4-acetamido-3-amino-1,5-anhydro-2,3,4-trideoxy-1-sulfo-D-glycero-D-galacto-octitol | | Formula: | C10 H20 N2 O8 S | | SMILES: | C1(OC(C(C(C1)N)NC(C)=O)C(C(CO)O)O)S(O)(=O)=O | | InChi: | InChI=1S/C10H20N2O8S/c1-4(14)12-8-5(11)2-7(21(17,18)19)20-10(8)9(16)6(15)3-13/h5-10,13,15-16H,2-3,11H2,1H3,(H,12,14)(H,17,18,19)/t5-,6+,7+,8+,9+,10+/m0/s1 | | Synonyms: | (1R)-4-(acetylamino)-3-amino-1,5-anhydro-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)-3-amino-1,5-anhydro-2,3,4-trideoxy-1-sulfo-D-glycero-D-galacto-octitol |
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 | | E5G | | Name: | 5-hydroxypentyl alpha-D-glucopyranoside | | Formula: | C11 H22 O7 | | SMILES: | O(CCCCCO)C1OC(C(O)C(O)C1O)CO | | InChi: | InChI=1S/C11H22O7/c12-4-2-1-3-5-17-11-10(16)9(15)8(14)7(6-13)18-11/h7-16H,1-6H2/t7-,8-,9+,10-,11+/m1/s1 | | Synonyms: | 5-hydroxypentyl alpha-D-glucoside | | Definition date: | 2012-01-11 | | Last modified: | 2020-07-17 | | Identifier: | 5-hydroxypentyl alpha-D-glucopyranoside |
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 | | EAG | | Name: | 2-aminoethyl 2-acetamido-2-deoxy-beta-D-glucopyranoside | | Formula: | C10 H20 N2 O6 | | SMILES: | O=C(NC1C(O)C(O)C(OC1OCCN)CO)C | | InChi: | InChI=1S/C10H20N2O6/c1-5(14)12-7-9(16)8(15)6(4-13)18-10(7)17-3-2-11/h6-10,13,15-16H,2-4,11H2,1H3,(H,12,14)/t6-,7-,8-,9-,10-/m1/s1 | | Synonyms: | 2-aminoethyl 2-(acetylamino)-2-deoxy-beta-D-glucopyranoside | | Definition date: | 2008-01-23 | | Last modified: | 2020-07-17 | | Identifier: | 2-aminoethyl 2-(acetylamino)-2-deoxy-beta-D-glucopyranoside |
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 | | EBG | | Name: | 2-[(2S)-oxiran-2-yl]ethyl alpha-D-glucopyranoside | | Formula: | C10 H18 O7 | | SMILES: | O(CCC1OC1)C2OC(C(O)C(O)C2O)CO | | InChi: | InChI=1S/C10H18O7/c11-3-6-7(12)8(13)9(14)10(17-6)15-2-1-5-4-16-5/h5-14H,1-4H2/t5-,6+,7+,8-,9+,10-/m0/s1 | | Synonyms: | 2-HYDROXYMETHYL-6-(2-OXIRANYL-ETHOXY)-TETRAHYDRO-PYRAN-3,4,5-TRIOL | | Definition date: | 2002-11-28 | | Last modified: | 2020-07-17 | | Identifier: | 2-[(2S)-oxiran-2-yl]ethyl alpha-D-glucopyranoside |
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