 | | ZGE | | Name: | 5-acetamido-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-3-fluoro-D-glycero-D-galacto-non-2-enonic acid | | Formula: | C12 H19 F N4 O7 | | SMILES: | O=C(C)NC1C(N/C(N)=N)C(F)=C(OC1C(O)C(CO)O)C(O)=O | | InChi: | InChI=1S/C12H19FN4O7/c1-3(19)16-7-6(17-12(14)15)5(13)9(11(22)23)24-10(7)8(21)4(20)2-18/h4,6-8,10,18,20-21H,2H2,1H3,(H,16,19)(H,22,23)(H4,14,15,17)/t4-,6+,7-,8-,10-/m1/s1 | | Synonyms: | (2R,3R,4R)-3-acetamido-4-carbamimidamido-5-fluoranyl-2-[(1R,2R)-1,2,3-tris(oxidanyl)propyl]-3,4-dihydro-2H-pyran-6-carb
oxylic acid | | Definition date: | 2012-10-31 | | Last modified: | 2020-07-17 | | Release date: | 2013-05-01 | | Identifier: | 5-(acetylamino)-2,6-anhydro-4-carbamimidamido-3,4,5-trideoxy-3-fluoro-D-glycero-D-galacto-non-2-enonic acid |
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 | | H53 | | Name: | (1S)-1,5-anhydro-1-(2,5-dihydroxyphenyl)-D-glucitol | | Formula: | C12 H16 O7 | | SMILES: | OC1C(O)C(O)C(OC1CO)c2cc(O)ccc2O | | InChi: | InChI=1S/C12H16O7/c13-4-8-9(16)10(17)11(18)12(19-8)6-3-5(14)1-2-7(6)15/h1-3,8-18H,4H2/t8-,9-,10+,11-,12+/m1/s1 | | Synonyms: | 2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOL | | Definition date: | 2006-01-23 | | Last modified: | 2020-07-17 | | Identifier: | (1S)-1,5-anhydro-1-(2,5-dihydroxyphenyl)-D-glucitol |
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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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 | | UAP | | Name: | 4-deoxy-2-O-sulfo-alpha-L-threo-hex-4-enopyranuronic acid | | Formula: | C6 H8 O9 S | | SMILES: | O=C(O)C=1OC(O)C(OS(=O)(=O)O)C(O)C=1 | | InChi: | InChI=1S/C6H8O9S/c7-2-1-3(5(8)9)14-6(10)4(2)15-16(11,12)13/h1-2,4,6-7,10H,(H,8,9)(H,11,12,13)/t2-,4+,6+/m0/s1 | | Synonyms: | 4-deoxy-2-O-sulfo-alpha-L-threo-hex-4-enuronic acid | | Definition date: | 1999-07-08 | | Last modified: | 2020-07-17 | | Identifier: | 4-deoxy-2-O-sulfo-alpha-L-threo-hex-4-enopyranuronic acid |
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 | | R1P | | Name: | 1-O-phosphono-alpha-D-ribofuranose | | Formula: | C5 H11 O8 P | | SMILES: | O=P(OC1OC(C(O)C1O)CO)(O)O | | InChi: | InChI=1S/C5H11O8P/c6-1-2-3(7)4(8)5(12-2)13-14(9,10)11/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5-/m1/s1 | | Synonyms: | RIBOSE-1-PHOSPHATE | | Definition date: | 1999-07-08 | | Last modified: | 2020-07-17 | | Identifier: | 1-O-phosphono-alpha-D-ribofuranose |
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 | | V3M | | Name: | 2-deoxy-2-fluoro-alpha-D-arabinofuranose | | Formula: | C5 H9 F O4 | | SMILES: | OC1OC(CO)C(C1F)O | | InChi: | InChI=1S/C5H9FO4/c6-3-4(8)2(1-7)10-5(3)9/h2-5,7-9H,1H2/t2-,3+,4-,5+/m1/s1 | | Definition date: | 2020-06-20 | | Last modified: | 2020-07-17 | | Release date: | 2020-07-01 | | Identifier: | 2-deoxy-2-fluoro-alpha-D-arabinofuranose |
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 | | V3P | | Name: | 4-iodophenyl 1,4-dithio-beta-D-glucopyranoside | | Formula: | C12 H15 I O4 S2 | | SMILES: | C1(C(CO)OC(C(C1O)O)Sc2ccc(cc2)I)S | | InChi: | InChI=1S/C12H15IO4S2/c13-6-1-3-7(4-2-6)19-12-10(16)9(15)11(18)8(5-14)17-12/h1-4,8-12,14-16,18H,5H2/t8-,9-,10-,11-,12+/m1/s1 | | Definition date: | 2020-06-21 | | Last modified: | 2020-07-17 | | Release date: | 2020-07-01 | | Identifier: | 4-iodophenyl 1,4-dithio-beta-D-glucopyranoside |
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 | | R2B | | Name: | 1,4-anhydro-D-erythro-pent-1-enitol | | Formula: | C5 H8 O4 | | SMILES: | OC1=COC(CO)C1O | | InChi: | InChI=1S/C5H8O4/c6-1-4-5(8)3(7)2-9-4/h2,4-8H,1H2/t4-,5+/m1/s1 | | Definition date: | 2005-05-11 | | Last modified: | 2020-07-17 | | Identifier: | 1,4-anhydro-D-erythro-pent-1-enitol |
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 | | R1X | | Name: | 1,4-anhydro-D-ribitol | | Formula: | C5 H10 O4 | | SMILES: | OCC1OCC(O)C1O | | InChi: | InChI=1S/C5H10O4/c6-1-4-5(8)3(7)2-9-4/h3-8H,1-2H2/t3-,4+,5-/m0/s1 | | Synonyms: | 1-deoxyribose | | Definition date: | 2008-10-03 | | Last modified: | 2020-07-17 | | Identifier: | 1,4-anhydro-D-ribitol |
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 | | MJJ | | Name: | methyl 9-O-acetyl-5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid | | Formula: | C14 H23 N O10 | | SMILES: | OC1C(NC(C)=O)C(OC(C1)(C(O)=O)OC)C(C(O)COC(=O)C)O | | InChi: | InChI=1S/C14H23NO10/c1-6(16)15-10-8(18)4-14(23-3,13(21)22)25-12(10)11(20)9(19)5-24-7(2)17/h8-12,18-20H,4-5H2,1-3H3,(H,15,16)(H,21,22)/t8-,9+,10+,11+,12+,14+/m0/s1 | | Synonyms: | methyl 9-O-acetyl-5-(acetylamino)-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid | | Definition date: | 2019-04-08 | | Last modified: | 2020-07-17 | | Release date: | 2019-06-05 | | Identifier: | methyl 9-O-acetyl-5-(acetylamino)-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid |
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 | | R2G | | Name: | 2,5-anhydro-4-deoxy-D-erythro-pent-4-enitol | | Formula: | C5 H8 O3 | | SMILES: | OC[CH]1OC=C[CH]1O | | InChi: | InChI=1S/C5H8O3/c6-3-5-4(7)1-2-8-5/h1-2,4-7H,3H2/t4-,5+/m1/s1 | | Definition date: | 2009-12-09 | | Last modified: | 2020-07-17 | | Identifier: | (2~{S},3~{R})-2-(hydroxymethyl)-2,3-dihydrofuran-3-ol |
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 | | LCN | | Name: | 1,5-anhydro-D-arabino-hex-1-enitol | | Formula: | C6 H10 O5 | | SMILES: | OC[CH]1OC=C(O)[CH](O)[CH]1O | | InChi: | InChI=1S/C6H10O5/c7-1-4-6(10)5(9)3(8)2-11-4/h2,4-10H,1H2/t4-,5-,6-/m1/s1 | | Definition date: | 2011-05-26 | | Last modified: | 2020-07-17 | | Identifier: | (2~{R},3~{S},4~{S})-2-(hydroxymethyl)-3,4-dihydro-2~{H}-pyran-3,4,5-triol |
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 | | RGG | | Name: | (2R)-2,3-dihydroxypropyl beta-D-galactopyranoside | | Formula: | C9 H18 O8 | | SMILES: | O(CC(O)CO)C1OC(C(O)C(O)C1O)CO | | InChi: | InChI=1S/C9H18O8/c10-1-4(12)3-16-9-8(15)7(14)6(13)5(2-11)17-9/h4-15H,1-3H2/t4-,5-,6+,7+,8-,9-/m1/s1 | | Synonyms: | (2R)-glyceryl-beta-D-galactopyranoside | | Definition date: | 2009-02-19 | | Last modified: | 2020-07-17 | | Identifier: | (2R)-2,3-dihydroxypropyl beta-D-galactopyranoside |
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 | | SA0 | | Name: | 2-(hydroxymethyl)phenyl beta-D-glucopyranoside | | Formula: | C13 H18 O7 | | SMILES: | O(c1c(cccc1)CO)C2OC(C(O)C(O)C2O)CO | | InChi: | InChI=1S/C13H18O7/c14-5-7-3-1-2-4-8(7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-4,9-18H,5-6H2/t9-,10-,11+,12-,13-/m1/s1 | | Synonyms: | Salicin | | Definition date: | 2011-10-14 | | Last modified: | 2020-07-17 | | Identifier: | 2-(hydroxymethyl)phenyl beta-D-glucopyranoside |
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 | | H6Q | | Name: | 2-O-[(R)-{[(2S)-1,1-dihydroxypropan-2-yl]oxy}(hydroxy)phosphoryl]-beta-D-glucopyranose | | Formula: | C9 H19 O11 P | | SMILES: | C[CH](O[P](O)(=O)O[CH]1[CH](O)O[CH](CO)[CH](O)[CH]1O)C(O)O | | InChi: | InChI=1S/C9H19O11P/c1-3(8(13)14)19-21(16,17)20-7-6(12)5(11)4(2-10)18-9(7)15/h3-15H,2H2,1H3,(H,16,17)/t3-,4+,5+,6-,7+,9+/m0/s1 | | Synonyms: | [(2~{S})-1,1-bis(oxidanyl)propan-2-yl]
[(2~{R},3~{R},4~{S},5~{S},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl] hydrogen phosphate | | Definition date: | 2018-11-19 | | Last modified: | 2020-07-17 | | Release date: | 2019-01-23 | | Identifier: | [(2~{S})-1,1-bis(oxidanyl)propan-2-yl]
[(2~{R},3~{R},4~{S},5~{S},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl] hydrogen phosphate |
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 | | RHA | | Name: | 6-deoxy-1-O-phosphono-alpha-L-rhamnopyranose | | Formula: | C6 H13 O8 P | | SMILES: | O=P(OC1OC(C(O)C(O)C1O)C)(O)O | | InChi: | InChI=1S/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)/t2-,3-,4+,5+,6-/m0/s1 | | Synonyms: | 6-DEOXY-MANNOSE-1'-PHOSPHATE | | Definition date: | 1999-07-08 | | Last modified: | 2020-07-17 | | Identifier: | 6-deoxy-1-O-phosphono-alpha-L-mannopyranose |
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 | | T68 | | Name: | N-[(pyridin-2-ylcarbonyl)carbamoyl]-beta-D-glucopyranosylamine | | Formula: | C13 H17 N3 O7 | | SMILES: | O=C(NC1OC(C(O)C(O)C1O)CO)NC(=O)c2ncccc2 | | InChi: | InChI=1S/C13H17N3O7/c17-5-7-8(18)9(19)10(20)12(23-7)16-13(22)15-11(21)6-3-1-2-4-14-6/h1-4,7-10,12,17-20H,5H2,(H2,15,16,21,22)/t7-,8-,9+,10-,12-/m1/s1 | | Synonyms: | N-[(pyridin-2-ylcarbonyl)carbamoyl]-beta-D-glucosylamine | | Definition date: | 2012-11-22 | | Last modified: | 2020-07-17 | | Release date: | 2013-12-11 | | Identifier: | N-[(pyridin-2-ylcarbonyl)carbamoyl]-beta-D-glucopyranosylamine |
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 | | ONN | | Name: | 2-[2-[[[(4~{R},8~{S},11~{S})-11-azanyl-8-[(4-hydroxyphenyl)methyl]-6,10-bis(oxidanylidene)-1,2-dithia-5,9-diazacyclotridec-4-yl]carbonylamino]methyl]phenyl]ethanoic acid | | Formula: | C26 H32 N4 O6 S2 | | SMILES: | N[CH]1CCSSC[CH](NC(=O)C[CH](Cc2ccc(O)cc2)NC1=O)C(=O)NCc3ccccc3CC(O)=O | | InChi: | InChI=1S/C26H32N4O6S2/c27-21-9-10-37-38-15-22(26(36)28-14-18-4-2-1-3-17(18)12-24(33)34)30-23(32)13-19(29-25(21)35)11-16-5-7-20(31)8-6-16/h1-8,19,21-22,31H,9-15,27H2,(H,28,36)(H,29,35)(H,30,32)(H,33,34)/t19-,21-,22-/m0/s1 | | Definition date: | 2020-03-21 | | Last modified: | 2020-07-17 | | Release date: | 2020-07-22 | | Identifier: | 2-[2-[[[(4~{R},8~{S},11~{S})-11-azanyl-8-[(4-hydroxyphenyl)methyl]-6,10-bis(oxidanylidene)-1,2-dithia-5,9-diazacyclotridec-4-yl]carbonylamino]methyl]phenyl]ethanoic acid |
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 | | MLB | | Name: | 6-O-alpha-D-galactopyranosyl-alpha-D-glucopyranose | | Formula: | C12 H22 O11 | | SMILES: | O(CC1OC(O)C(O)C(O)C1O)C2OC(C(O)C(O)C2O)CO | | InChi: | InChI=1S/C12H22O11/c13-1-3-5(14)8(17)10(19)12(23-3)21-2-4-6(15)7(16)9(18)11(20)22-4/h3-20H,1-2H2/t3-,4-,5+,6-,7+,8+,9-,10-,11+,12+/m1/s1 | | Synonyms: | melibiose | | Definition date: | 2010-08-26 | | Last modified: | 2020-07-17 | | Identifier: | 6-O-alpha-D-galactopyranosyl-alpha-D-glucopyranose |
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 | | H6Z | | Name: | 2-O-[(R)-{[(2S)-1,1-dihydroxypropan-2-yl]oxy}(hydroxy)phosphoryl]-alpha-D-glucopyranose | | Formula: | C9 H19 O11 P | | SMILES: | C[CH](O[P](O)(=O)O[CH]1[CH](O)O[CH](CO)[CH](O)[CH]1O)C(O)O | | InChi: | InChI=1S/C9H19O11P/c1-3(8(13)14)19-21(16,17)20-7-6(12)5(11)4(2-10)18-9(7)15/h3-15H,2H2,1H3,(H,16,17)/t3-,4+,5+,6-,7+,9-/m0/s1 | | Synonyms: | [(2~{S})-1,1-bis(oxidanyl)propan-2-yl]
[(2~{S},3~{R},4~{S},5~{S},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl] hydrogen phosphate | | Definition date: | 2018-11-19 | | Last modified: | 2020-07-17 | | Release date: | 2019-01-23 | | Identifier: | [(2~{S})-1,1-bis(oxidanyl)propan-2-yl]
[(2~{S},3~{R},4~{S},5~{S},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl] hydrogen phosphate |
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 | | T6D | | Name: | alpha-D-glucopyranosyl 6-O-decanoyl-alpha-D-glucopyranoside | | Formula: | C22 H40 O12 | | SMILES: | C1(C(C(O)C(C(O1)COC(CCCCCCCCC)=O)O)O)OC2C(C(C(C(CO)O2)O)O)O | | InChi: | InChI=1S/C22H40O12/c1-2-3-4-5-6-7-8-9-14(24)31-11-13-16(26)18(28)20(30)22(33-13)34-21-19(29)17(27)15(25)12(10-23)32-21/h12-13,15-23,25-30H,2-11H2,1H3/t12-,13-,15-,16-,17+,18+,19-,20-,21-,22-/m1/s1 | | Synonyms: | trehalose 6-decanoate | | Definition date: | 2018-10-02 | | Last modified: | 2020-07-17 | | Release date: | 2019-09-18 | | Identifier: | alpha-D-glucopyranosyl 6-O-decanoyl-alpha-D-glucopyranoside |
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 | | LRH | | Name: | 6-deoxy-beta-L-fructofuranose | | Formula: | C6 H12 O5 | | SMILES: | OC1C(O)C(OC1(O)CO)C | | InChi: | InChI=1S/C6H12O5/c1-3-4(8)5(9)6(10,2-7)11-3/h3-5,7-10H,2H2,1H3/t3-,4-,5+,6-/m0/s1 | | Synonyms: | 6-deoxy-beta-L-fructose | | Definition date: | 2007-04-13 | | Last modified: | 2020-07-17 | | Identifier: | 6-deoxy-beta-L-fructofuranose |
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 | | LDY | | Name: | alpha-D-lyxopyranose | | Formula: | C5 H10 O5 | | SMILES: | OC1C(O)COC(O)C1O | | InChi: | InChI=1S/C5H10O5/c6-2-1-10-5(9)4(8)3(2)7/h2-9H,1H2/t2-,3+,4+,5+/m1/s1 | | Synonyms: | alpha-D-lyxose | | Definition date: | 2008-01-09 | | Last modified: | 2020-07-17 | | Identifier: | alpha-D-lyxopyranose |
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 | | T6P | | Name: | Trehalose-6-phosphate | | Formula: | C12 H23 O14 P | | SMILES: | O=P(O)(O)OCC2OC(OC1OC(CO)C(O)C(O)C1O)C(O)C(O)C2O | | InChi: | InChI=1S/C12H23O14P/c13-1-3-5(14)7(16)9(18)11(24-3)26-12-10(19)8(17)6(15)4(25-12)2-23-27(20,21)22/h3-19H,1-2H2,(H2,20,21,22)/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-/m1/s1 | | Synonyms: | 6-O-phosphono-alpha-D-glucopyranosyl alpha-D-glucopyranoside | | Definition date: | 1999-08-20 | | Last modified: | 2020-07-17 | | Identifier: | 6-O-phosphono-alpha-D-glucopyranosyl alpha-D-glucopyranoside |
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 | | MLR | | Name: | MALTOTRIOSE | | Formula: | C18 H32 O16 | | SMILES: | O(C1C(OC(O)C(O)C1O)CO)C3OC(C(OC2OC(CO)C(O)C(O)C2O)C(O)C3O)CO | | InChi: | InChI=1S/C18H32O16/c19-1-4-7(22)8(23)12(27)17(31-4)34-15-6(3-21)32-18(13(28)10(15)25)33-14-5(2-20)30-16(29)11(26)9(14)24/h4-29H,1-3H2/t4-,5-,6-,7-,8+,9-,10-,11-,12-,13-,14-,15-,16+,17-,18-/m1/s1 | | Synonyms: | AMYLOTRIOSE | | Definition date: | 2003-03-03 | | Last modified: | 2020-07-17 | | Identifier: | alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranose |
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