 | | 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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 | | BQY | | Name: | 2-methoxyphenyl beta-D-galactopyranoside | | Formula: | C13 H18 O7 | | SMILES: | c2cc(c(OC1C(O)C(O)C(C(CO)O1)O)cc2)OC | | InChi: | InChI=1S/C13H18O7/c1-18-7-4-2-3-5-8(7)19-13-12(17)11(16)10(15)9(6-14)20-13/h2-5,9-17H,6H2,1H3/t9-,10+,11+,12-,13-/m1/s1 | | Synonyms: | o-methoxyphenyl beta-galactoside | | Definition date: | 2017-08-23 | | Last modified: | 2020-07-17 | | Release date: | 2018-02-28 | | Identifier: | 2-methoxyphenyl beta-D-galactopyranoside |
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 | | BS7 | | Name: | 8-hydroxyquinoline beta-galactopyranoside | | Formula: | C15 H17 N O6 | | SMILES: | C3(C(C(Oc2c1c(cccn1)ccc2)OC(C3O)CO)O)O | | InChi: | InChI=1S/C15H17NO6/c17-7-10-12(18)13(19)14(20)15(22-10)21-9-5-1-3-8-4-2-6-16-11(8)9/h1-6,10,12-15,17-20H,7H2/t10-,12+,13+,14-,15-/m1/s1 | | Synonyms: | quinolin-8-yl beta-D-galactopyranoside | | Definition date: | 2017-08-23 | | Last modified: | 2020-07-17 | | Release date: | 2018-02-28 | | Identifier: | quinolin-8-yl beta-D-galactopyranoside |
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 | | BTG | | Name: | ortho-biphenyl-2'-carboxyl N-acetyl-beta-galactosaminoside | | Formula: | C21 H23 N O8 | | SMILES: | c3ccc(c1cccc(C(O)=O)c1)c(OC2C(NC(=O)C)C(O)C(C(O2)CO)O)c3 | | InChi: | InChI=1S/C21H23NO8/c1-11(24)22-17-19(26)18(25)16(10-23)30-21(17)29-15-8-3-2-7-14(15)12-5-4-6-13(9-12)20(27)28/h2-9,16-19,21,23,25-26H,10H2,1H3,(H,22,24)(H,27,28)/t16-,17-,18+,19-,21-/m1/s1 | | Synonyms: | 2'-{[2-(acetylamino)-2-deoxy-beta-D-galactopyranosyl]oxy}[1,1'-biphenyl]-3-carboxylic acid | | Definition date: | 2017-08-24 | | Last modified: | 2020-07-17 | | Release date: | 2018-02-28 | | Identifier: | 2'-{[2-(acetylamino)-2-deoxy-beta-D-galactopyranosyl]oxy}[1,1'-biphenyl]-3-carboxylic acid |
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 | | 0TS | | Name: | beta-D-glucopyranosyl-(1->4)-4-thio-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-4-thio-beta-D-glucopyrano
syl-(1->4)-1-thio-beta-D-glucopyranose | | Formula: | C30 H52 O23 S3 | | SMILES: | S(C2C(OC(OC1C(O)C(O)C(S)OC1CO)C(O)C2O)CO)C5OC(C(OC4OC(CO)C(SC3OC(CO)C(O)C(O)C3O)C(O)C4O)C(O)C5O)CO | | InChi: | InChI=1S/C30H52O23S3/c31-1-6-11(36)12(37)20(45)29(50-6)55-24-9(4-34)48-27(18(43)15(24)40)53-23-8(3-33)51-30(21(46)14(23)39)56-25-10(5-35)47-26(17(42)16(25)41)52-22-7(2-32)49-28(54)19(44)13(22)38/h6-46,54H,1-5H2/t6-,7-,8-,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26+,27+,28+,29+,30+/m1/s1 | | Synonyms: | hemithiocellodextrin | | Definition date: | 2012-06-08 | | Last modified: | 2020-07-17 | | Identifier: | beta-D-glucopyranosyl-(1->4)-4-thio-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranosyl-(1->4)-4-thio-beta-D-glucopyranosyl-(1->4)-1-thio-beta-D-glucopyranose |
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 | | BTU | | Name: | 3-O-alpha-D-glucopyranosyl-beta-D-fructofuranose | | Formula: | C12 H22 O11 | | SMILES: | O(C1C(O)C(OC1(O)CO)CO)C2OC(CO)C(O)C(O)C2O | | InChi: | InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)22-10-7(17)5(2-14)23-12(10,20)3-15/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12-/m1/s1 | | Definition date: | 2011-11-01 | | Last modified: | 2020-07-17 | | Identifier: | 3-O-alpha-D-glucopyranosyl-beta-D-fructofuranose |
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 | | 0UB | | Name: | beta-D-fructofuranosyl-(2->6)-beta-D-fructofuranosyl-(2->6)-beta-D-fructofuranose | | Formula: | C18 H32 O16 | | SMILES: | O3C(COC1(OC(C(O)C1O)COC2(OC(CO)C(O)C2O)CO)CO)C(O)C(O)C3(O)CO | | InChi: | InChI=1S/C18H32O16/c19-1-7-10(23)14(27)17(5-21,33-7)31-3-9-12(25)15(28)18(6-22,34-9)30-2-8-11(24)13(26)16(29,4-20)32-8/h7-15,19-29H,1-6H2/t7-,8-,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-/m1/s1 | | Synonyms: | Levantriose | | Definition date: | 2012-06-15 | | Last modified: | 2020-07-17 | | Identifier: | beta-D-fructofuranosyl-(2->6)-beta-D-fructofuranosyl-(2->6)-beta-D-fructofuranose |
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 | | BWG | | Name: | N-{5-[(1R)-1-hydroxyethyl]-1,3-thiazol-2-yl}-alpha-D-mannopyranosylamine | | Formula: | C11 H16 N2 O6 S | | SMILES: | O1C(CO)C(O)C(O)C(O)C1Nc2ncc(s2)C(O)C | | InChi: | InChI=1S/C11H18N2O6S/c1-4(15)6-2-12-11(20-6)13-10-9(18)8(17)7(16)5(3-14)19-10/h2,4-5,7-10,14-18H,3H2,1H3,(H,12,13)/t4-,5-,7-,8+,9+,10+/m1/s1 | | Synonyms: | N-{5-[(1R)-1-hydroxyethyl]-1,3-thiazol-2-yl}-alpha-D-mannosylamine | | Definition date: | 2013-01-28 | | Last modified: | 2020-07-17 | | Release date: | 2013-07-10 | | Identifier: | N-{5-[(1R)-1-hydroxyethyl]-1,3-thiazol-2-yl}-alpha-D-mannopyranosylamine |
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 | | BXP | | Name: | 4-O-beta-D-xylopyranosyl-beta-D-xylopyranose | | Formula: | C10 H18 O9 | | SMILES: | O(C1COC(O)C(O)C1O)C2OCC(O)C(O)C2O | | InChi: | InChI=1S/C10H18O9/c11-3-1-18-10(8(15)5(3)12)19-4-2-17-9(16)7(14)6(4)13/h3-16H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10+/m1/s1 | | Synonyms: | XYLOBIOSE | | Definition date: | 2006-11-09 | | Last modified: | 2020-07-17 | | Identifier: | 4-O-beta-D-xylopyranosyl-beta-D-xylopyranose |
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 | | 1S3 | | Name: | (2R,3aR,5R,6S,7S,7aR)-5-(hydroxymethyl)tetrahydro-3aH-[1,3,2]dioxaphospholo[4,5-b]pyran-2,6,7-triol 2-oxide | | Formula: | C6 H11 O8 P | | SMILES: | O=P1(OC2C(O)C(O)C(OC2O1)CO)O | | InChi: | InChI=1S/C6H11O8P/c7-1-2-3(8)4(9)5-6(12-2)14-15(10,11)13-5/h2-9H,1H2,(H,10,11)/t2-,3-,4+,5-,6-/m1/s1 | | Synonyms: | Glucose1,2cyclic phosphate | | Definition date: | 2013-05-15 | | Last modified: | 2020-07-17 | | Release date: | 2013-12-11 | | Identifier: | (2R,3aR,5R,6S,7S,7aR)-5-(hydroxymethyl)tetrahydro-3aH-[1,3,2]dioxaphospholo[4,5-b]pyran-2,6,7-triol 2-oxide |
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 | | 1S4 | | Name: | alpha-muramic acid | | Formula: | C9 H17 N O7 | | SMILES: | O=C(O)C(OC1C(O)C(OC(O)C1N)CO)C | | InChi: | InChI=1S/C9H17NO7/c1-3(8(13)14)16-7-5(10)9(15)17-4(2-11)6(7)12/h3-7,9,11-12,15H,2,10H2,1H3,(H,13,14)/t3-,4-,5-,6-,7-,9+/m1/s1 | | Synonyms: | muramic acid | | Definition date: | 2013-05-15 | | Last modified: | 2020-07-17 | | Release date: | 2020-07-29 | | Identifier: | 2-amino-3-O-[(1R)-1-carboxyethyl]-2-deoxy-alpha-D-glucopyranose |
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 | | 1SD | | Name: | (1S)-1,5-anhydro-1-sulfamoyl-D-galactitol | | Formula: | C6 H13 N O7 S | | SMILES: | O=S(=O)(N)C1OC(C(O)C(O)C1O)CO | | InChi: | InChI=1S/C6H13NO7S/c7-15(12,13)6-5(11)4(10)3(9)2(1-8)14-6/h2-6,8-11H,1H2,(H2,7,12,13)/t2-,3+,4+,5-,6+/m1/s1 | | Synonyms: | (2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxane-2-sulfonamide | | Definition date: | 2009-06-02 | | Last modified: | 2020-07-17 | | Identifier: | (1S)-1,5-anhydro-1-sulfamoyl-D-galactitol |
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 | | I57 | | Name: | 2,6-anhydro-3,4,5-trideoxy-5-[(2-methylpropanoyl)amino]-4-(4-phenyl-1H-1,2,3-triazol-1-yl)-D-glycero-D-galacto-non-2-en
onic acid | | Formula: | C21 H26 N4 O7 | | SMILES: | CC(C)C(=O)N[CH]1[CH](OC(=C[CH]1n2cc(nn2)c3ccccc3)C(O)=O)[CH](O)[CH](O)CO | | InChi: | InChI=1S/C21H26N4O7/c1-11(2)20(29)22-17-14(25-9-13(23-24-25)12-6-4-3-5-7-12)8-16(21(30)31)32-19(17)18(28)15(27)10-26/h3-9,11,14-15,17-19,26-28H,10H2,1-2H3,(H,22,29)(H,30,31)/t14-,15+,17+,18+,19+/m0/s1 | | Synonyms: | (2~{R},3~{R},4~{S})-3-(2-methylpropanoylamino)-4-(4-phenyl-1,2,3-triazol-1-yl)-2-[(1~{R},2~{R})-1,2,3-tris(oxidanyl)pro
pyl]-3,4-dihydro-2~{H}-pyran-6-carboxylic acid | | Definition date: | 2016-07-21 | | Last modified: | 2020-07-17 | | Release date: | 2017-07-12 | | Identifier: | (2~{R},3~{R},4~{S})-3-(2-methylpropanoylamino)-4-(4-phenyl-1,2,3-triazol-1-yl)-2-[(1~{R},2~{R})-1,2,3-tris(oxidanyl)pro
pyl]-3,4-dihydro-2~{H}-pyran-6-carboxylic acid |
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 | | 20S | | Name: | BETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-ALPHA-D-GLUCOPYRANOSIDE | | Formula: | C20 H36 O12 | | SMILES: | O=C(OCC2OC(OC1(OC(C(O)C1O)CO)CO)C(O)C(O)C2O)CCCCCCC | | InChi: | InChI=1S/C20H36O12/c1-2-3-4-5-6-7-13(23)29-9-12-14(24)16(26)17(27)19(30-12)32-20(10-22)18(28)15(25)11(8-21)31-20/h11-12,14-19,21-22,24-28H,2-10H2,1H3/t11-,12-,14-,15-,16+,17-,18+,19-,20+/m1/s1 | | Definition date: | 2006-01-05 | | Last modified: | 2020-07-17 | | Identifier: | beta-D-fructofuranosyl 6-O-octanoyl-alpha-D-glucopyranoside |
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 | | 20X | | Name: | N-({(2E)-2-[(4-fluorophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine | | Formula: | C14 H18 F N3 O5 S | | SMILES: | S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2ccc(F)cc2 | | InChi: | InChI=1S/C14H18FN3O5S/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: | 4-fluorobenzaldehyde-4-(beta-D-glucopyranosyl)-thiosemicarbazone | | Definition date: | 2010-04-30 | | Last modified: | 2020-07-17 | | Identifier: | N-{[(2E)-2-(4-fluorobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine |
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 | | IAB | | Name: | ISO-ACARBOSE | | Formula: | C25 H43 N O18 | | SMILES: | O(CC1OC(O)C(O)C(O)C1O)C4OC(C(OC3OC(C)C(NC2C=C(CO)C(O)C(O)C2O)C(O)C3O)C(O)C4O)CO | | InChi: | InChI=1S/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(29)16(33)13(8)30)15(32)20(37)25(41-6)44-22-9(4-28)43-24(21(38)18(22)35)40-5-10-14(31)17(34)19(36)23(39)42-10/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12-,13+,14-,15+,16+,17+,18-,19-,20-,21-,22-,23-,24+,25-/m1/s1 | | Synonyms: | 4,6-DIDEOXY-4-{[4,5,6-TRIHYDROXY-3-(HYDROXYMETHYL)CYCLOHEX-2-EN-1-YL]AMINO}-ALPHA-D-LYXO-HEXOPYRANOSYL-(1->4)-ALPHA-D-T
HREO-HEXOPYRANOSYL-(1->6)-ALPHA-L-THREO-HEXOPYRANOSE | | Definition date: | 2004-09-15 | | Last modified: | 2020-07-17 | | Identifier: | 4,6-dideoxy-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-alpha-D-glucopyranosyl-(1->4)-alpha-D-glucopyranosyl-(1->6)-beta-D-glucopyranose |
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 | | IDC | | Name: | (5R,6R,7R,8S)-7,8-dihydroxy-5-(hydroxymethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl beta-D-glucopyranoside | | Formula: | C14 H22 N2 O9 | | SMILES: | O(C2C(O)C(O)c1nccn1C2CO)C3OC(C(O)C(O)C3O)CO | | InChi: | InChI=1S/C14H22N2O9/c17-3-5-12(9(21)10(22)13-15-1-2-16(5)13)25-14-11(23)8(20)7(19)6(4-18)24-14/h1-2,5-12,14,17-23H,3-4H2/t5-,6-,7-,8+,9-,10-,11-,12-,14+/m1/s1 | | Synonyms: | 5-HYDROXYMETHYL-5,6,7,8-TETRAHYDRO-IMIDAZO[1,2-A]PYRIDIN-6YL-7,8-DIOL-GLUCOPYRANOSIDE | | Definition date: | 1999-08-03 | | Last modified: | 2020-07-17 | | Identifier: | (5R,6R,7R,8S)-7,8-dihydroxy-5-(hydroxymethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl beta-D-glucopyranoside |
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 | | IDF | | Name: | 5-fluoro-alpha-L-idopyranosyluronic acid fluoride | | Formula: | C6 H8 F2 O6 | | SMILES: | FC1OC(F)(C(=O)O)C(O)C(O)C1O | | InChi: | InChI=1S/C6H8F2O6/c7-4-2(10)1(9)3(11)6(8,14-4)5(12)13/h1-4,9-11H,(H,12,13)/t1-,2-,3+,4-,6-/m1/s1 | | Synonyms: | 5-fluoro-alpha-L-idosyluronic acid fluoride | | Definition date: | 2013-05-07 | | Last modified: | 2020-07-17 | | Release date: | 2013-09-18 | | Identifier: | (2S,3S,4R,5R,6S)-2,6-difluoro-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid (non-preferred name) |
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 | | IDS | | Name: | 2-O-sulfo-alpha-L-idopyranuronic acid | | Formula: | C6 H10 O10 S | | SMILES: | O=S(=O)(OC1C(O)C(O)C(OC1O)C(=O)O)O | | InChi: | InChI=1S/C6H10O10S/c7-1-2(8)4(16-17(12,13)14)6(11)15-3(1)5(9)10/h1-4,6-8,11H,(H,9,10)(H,12,13,14)/t1-,2-,3+,4+,6+/m0/s1 | | Synonyms: | O2-SULFO-GLUCURONIC ACID | | Definition date: | 1999-07-08 | | Last modified: | 2020-07-17 | | Identifier: | 2-O-sulfo-alpha-L-idopyranuronic acid |
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 | | IDU | | Name: | 2-O-sulfo-beta-L-altropyranuronic acid | | Formula: | C6 H10 O10 S | | SMILES: | O=C(O)C1OC(O)C(OS(=O)(=O)O)C(O)C1O | | InChi: | InChI=1S/C6H10O10S/c7-1-2(8)4(16-17(12,13)14)6(11)15-3(1)5(9)10/h1-4,6-8,11H,(H,9,10)(H,12,13,14)/t1-,2+,3-,4-,6+/m1/s1 | | Synonyms: | 2-O-sulfo-beta-L-altruronic acid | | Definition date: | 1999-07-08 | | Last modified: | 2020-07-17 | | Identifier: | 2-O-sulfo-beta-L-altropyranuronic acid |
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 | | IDX | | Name: | 2-O-sulfo-alpha-L-gulopyranuronic acid | | Formula: | C6 H10 O10 S | | SMILES: | O=S(=O)(OC1C(O)C(O)C(OC1O)C(=O)O)O | | InChi: | InChI=1S/C6H10O10S/c7-1-2(8)4(16-17(12,13)14)6(11)15-3(1)5(9)10/h1-4,6-8,11H,(H,9,10)(H,12,13,14)/t1-,2-,3+,4-,6+/m0/s1 | | Synonyms: | 2-O-sulfo-alpha-L-guluronic acid | | Definition date: | 2008-06-13 | | Last modified: | 2020-07-17 | | Identifier: | 2-O-sulfo-alpha-L-gulopyranuronic acid |
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 | | IDY | | Name: | 1-O-methyl-2-O-sulfo-alpha-L-idopyranuronic acid | | Formula: | C7 H12 O10 S | | SMILES: | O=C(O)C1OC(OC)C(OS(=O)(=O)O)C(O)C1O | | InChi: | InChI=1S/C7H12O10S/c1-15-7-5(17-18(12,13)14)3(9)2(8)4(16-7)6(10)11/h2-5,7-9H,1H3,(H,10,11)(H,12,13,14)/t2-,3-,4+,5+,7+/m0/s1 | | Synonyms: | methyl 2-O-sulfo-alpha-L-idopyranosiduronic acid | | Definition date: | 2011-11-03 | | Last modified: | 2020-07-17 | | Release date: | 2012-11-23 | | Identifier: | methyl 2-O-sulfo-alpha-L-idopyranosiduronic acid |
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 | | GRF | | Name: | 5-O-phosphono-beta-D-ribofuranosylamine | | Formula: | C5 H12 N O7 P | | SMILES: | O=P(O)(O)OCC1OC(N)C(O)C1O | | InChi: | InChI=1S/C5H12NO7P/c6-5-4(8)3(7)2(13-5)1-12-14(9,10)11/h2-5,7-8H,1,6H2,(H2,9,10,11)/t2-,3-,4-,5-/m1/s1 | | Synonyms: | 5-O-phosphono-beta-D-ribosylamine | | Definition date: | 2005-06-16 | | Last modified: | 2020-07-17 | | Identifier: | 5-O-phosphono-beta-D-ribofuranosylamine |
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 | | GRX | | Name: | (1R)-1,5-anhydro-1-[(S)-fluoro(phosphono)methyl]-D-glucitol | | Formula: | C7 H14 F O8 P | | SMILES: | O=P(O)(O)C(F)C1OC(C(O)C(O)C1O)CO | | InChi: | InChI=1S/C7H14FO8P/c8-7(17(13,14)15)6-5(12)4(11)3(10)2(1-9)16-6/h2-7,9-12H,1H2,(H2,13,14,15)/t2-,3-,4+,5-,6-,7+/m1/s1 | | Synonyms: | (S)-1-beta-phosphonofluoromethylene-1-deoxy-D-glucopyranose | | Definition date: | 2013-09-09 | | Last modified: | 2020-07-17 | | Release date: | 2014-07-16 | | Identifier: | (1R)-1,5-anhydro-1-[(S)-fluoro(phosphono)methyl]-D-glucitol |
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 | | GS9 | | Name: | naphthalen-2-yl 1-thio-beta-D-galactopyranoside | | Formula: | C16 H18 O5 S | | SMILES: | S(c1ccc2c(c1)cccc2)C3OC(C(O)C(O)C3O)CO | | InChi: | InChI=1S/C16H18O5S/c17-8-12-13(18)14(19)15(20)16(21-12)22-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12-20H,8H2/t12-,13+,14+,15-,16+/m1/s1 | | Synonyms: | naphthalen-2-yl 1-thio-beta-D-galactoside | | Definition date: | 2011-11-08 | | Last modified: | 2020-07-17 | | Release date: | 2012-10-12 | | Identifier: | naphthalen-2-yl 1-thio-beta-D-galactopyranoside |
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