| 07E | Name: | (3S)-3-hydroxybutyl beta-D-xylopyranoside | Formula: | C9 H18 O6 | SMILES: | O(CCC(O)C)C1OCC(O)C(O)C1O | InChi: | InChI=1S/C9H18O6/c1-5(10)2-3-14-9-8(13)7(12)6(11)4-15-9/h5-13H,2-4H2,1H3/t5-,6+,7-,8+,9+/m0/s1 | Synonyms: | (3S)-3-hydroxybutyl beta-D-xyloside | Definition date: | 2011-09-23 | Last modified: | 2020-07-17 | Release date: | 2017-07-12 | Identifier: | (3S)-3-hydroxybutyl beta-D-xylopyranoside |
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| ARA | Name: | alpha-L-arabinopyranose | 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+/m0/s1 | Synonyms: | alpha-L-arabinose | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | alpha-L-arabinopyranose |
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| ARB | Name: | beta-L-arabinopyranose | 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-/m0/s1 | Synonyms: | beta-L-arabinose | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | beta-L-arabinopyranose |
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| ARI | Name: | (2R,3R,6R)-6-hydroxy-2-methyltetrahydro-2H-pyran-3-yl acetate | Formula: | C8 H14 O4 | SMILES: | O=C(OC1C(OC(O)CC1)C)C | InChi: | InChI=1S/C8H14O4/c1-5-7(12-6(2)9)3-4-8(10)11-5/h5,7-8,10H,3-4H2,1-2H3/t5-,7-,8-/m1/s1 | Synonyms: | [O4]-ACETOXY-2,3-DIDEOXYFUCOSE | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | (2R,3R,6R)-6-hydroxy-2-methyltetrahydro-2H-pyran-3-yl acetate |
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| ARW | Name: | methyl beta-D-arabinopyranoside | Formula: | C6 H12 O5 | SMILES: | OC1C(O)C(O)COC1OC | InChi: | InChI=1S/C6H12O5/c1-10-6-5(9)4(8)3(7)2-11-6/h3-9H,2H2,1H3/t3-,4-,5+,6-/m1/s1 | Synonyms: | methyl beta-D-arabinoside | Definition date: | 2005-04-12 | Last modified: | 2020-07-17 | Identifier: | methyl beta-D-arabinopyranoside |
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| ASC | Name: | ASCORBIC ACID | Formula: | C6 H8 O6 | SMILES: | O=C1OC(C(O)=C1O)C(O)CO | InChi: | InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1 | Synonyms: | Vitamin C | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | (5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxyfuran-2(5H)-one (non-preferred name) |
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| ASG | Name: | 2-acetamido-2-deoxy-4-O-sulfo-beta-D-galactopyranose | Formula: | C8 H15 N O9 S | SMILES: | O=S(=O)(O)OC1C(OC(O)C(NC(=O)C)C1O)CO | InChi: | InChI=1S/C8H15NO9S/c1-3(11)9-5-6(12)7(18-19(14,15)16)4(2-10)17-8(5)13/h4-8,10,12-13H,2H2,1H3,(H,9,11)(H,14,15,16)/t4-,5-,6-,7+,8-/m1/s1 | Synonyms: | 2-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-4-SULFATE | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | 2-(acetylamino)-2-deoxy-4-O-sulfo-beta-D-galactopyranose |
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| ASO | Name: | 1,5-anhydro-D-glucitol | Formula: | C6 H12 O5 | SMILES: | OC1C(OCC(O)C1O)CO | InChi: | InChI=1S/C6H12O5/c7-1-4-6(10)5(9)3(8)2-11-4/h3-10H,1-2H2/t3-,4+,5+,6+/m0/s1 | Synonyms: | 1,5-ANHYDROSORBITOL | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | 1,5-anhydro-D-glucitol |
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| P53 | Name: | 2-(hydroxymethyl)phenyl 6-O-phosphono-beta-D-glucopyranoside | Formula: | C13 H19 O10 P | SMILES: | O=P(O)(O)OCC2OC(Oc1c(cccc1)CO)C(O)C(O)C2O | InChi: | InChI=1S/C13H19O10P/c14-5-7-3-1-2-4-8(7)22-13-12(17)11(16)10(15)9(23-13)6-21-24(18,19)20/h1-4,9-17H,5-6H2,(H2,18,19,20)/t9-,10-,11+,12-,13-/m1/s1 | Synonyms: | Salicin-6-phosphate | Definition date: | 2012-06-01 | Last modified: | 2020-07-17 | Identifier: | 2-(hydroxymethyl)phenyl 6-O-phosphono-beta-D-glucopyranoside |
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| P6P | Name: | 6-O-phosphono-alpha-D-fructofuranose | Formula: | C6 H13 O9 P | SMILES: | O=P(O)(O)OCC1OC(O)(CO)C(O)C1O | InChi: | InChI=1S/C6H13O9P/c7-2-6(10)5(9)4(8)3(15-6)1-14-16(11,12)13/h3-5,7-10H,1-2H2,(H2,11,12,13)/t3-,4-,5+,6+/m1/s1 | Synonyms: | alpha fructose-6-phosphate | Definition date: | 2009-08-17 | Last modified: | 2020-07-17 | Identifier: | 6-O-phosphono-alpha-D-fructofuranose |
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| 7NU | Name: | phenyl 6,7-anhydro-D-glycero-beta-D-galacto-heptopyranoside | Formula: | C13 H16 O6 | SMILES: | O[CH]1[CH](O)[CH](O[CH]([CH]2CO2)[CH]1O)Oc3ccccc3 | InChi: | InChI=1S/C13H16O6/c14-9-10(15)12(8-6-17-8)19-13(11(9)16)18-7-4-2-1-3-5-7/h1-5,8-16H,6H2/t8-,9+,10-,11-,12-,13-/m1/s1 | Synonyms: | Phenyl 6,7-dideoxy-6,7-epoxy-beta-D-galacto-heptopyranoside(6D) | Definition date: | 2016-11-28 | Last modified: | 2020-07-17 | Release date: | 2017-10-11 | Identifier: | (2~{S},3~{R},4~{S},5~{R},6~{S})-2-[(2~{R})-oxiran-2-yl]-6-phenoxy-oxane-3,4,5-triol |
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| PAV | Name: | (2R,4S)-2-methyl-2,3,3,4-tetrahydroxytetrahydrofuran | Formula: | C5 H10 O5 | SMILES: | OC1(O)C(O)(OCC1O)C | InChi: | InChI=1S/C5H10O5/c1-4(7)5(8,9)3(6)2-10-4/h3,6-9H,2H2,1H3/t3-,4+/m0/s1 | Definition date: | 2004-06-16 | Last modified: | 2020-07-17 | Identifier: | (2R,4S)-2-methyldihydrofuran-2,3,3,4(2H)-tetrol (non-preferred name) |
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| PDX | Name: | 2,3-di-O-sulfo-alpha-D-glucopyranose | Formula: | C6 H12 O12 S2 | SMILES: | O=S(=O)(O)OC1C(O)C(OC(O)C1OS(=O)(=O)O)CO | InChi: | InChI=1S/C6H12O12S2/c7-1-2-3(8)4(17-19(10,11)12)5(6(9)16-2)18-20(13,14)15/h2-9H,1H2,(H,10,11,12)(H,13,14,15)/t2-,3-,4+,5-,6+/m1/s1 | Synonyms: | 2,3-di-O-sulfo-alpha-D-glucose | Definition date: | 2002-10-23 | Last modified: | 2020-07-17 | Identifier: | 2,3-di-O-sulfo-alpha-D-glucopyranose |
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| PH5 | Name: | benzyl 3,5-dideoxy-5-(propanoylamino)-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid | Formula: | C19 H27 N O9 | SMILES: | O=C(O)C2(OCc1ccccc1)OC(C(O)C(O)CO)C(NC(=O)CC)C(O)C2 | InChi: | InChI=1S/C19H27NO9/c1-2-14(24)20-15-12(22)8-19(18(26)27,28-10-11-6-4-3-5-7-11)29-17(15)16(25)13(23)9-21/h3-7,12-13,15-17,21-23,25H,2,8-10H2,1H3,(H,20,24)(H,26,27)/t12-,13+,15+,16+,17+,19+/m0/s1 | Synonyms: | 2-PHENYL-PROP5AC | Definition date: | 2005-06-27 | Last modified: | 2020-07-17 | Identifier: | benzyl 3,5-dideoxy-5-(propanoylamino)-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid |
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| BND | Name: | methyl 5-acetamido-3,5,9-trideoxy-9-[(phenylcarbonyl)amino]-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid | Formula: | C19 H26 N2 O9 | SMILES: | O=C(c1ccccc1)NCC(O)C(O)C2OC(OC)(C(=O)O)CC(O)C2NC(=O)C | InChi: | InChI=1S/C19H26N2O9/c1-10(22)21-14-12(23)8-19(29-2,18(27)28)30-16(14)15(25)13(24)9-20-17(26)11-6-4-3-5-7-11/h3-7,12-16,23-25H,8-9H2,1-2H3,(H,20,26)(H,21,22)(H,27,28)/t12-,13+,14+,15+,16+,19+/m0/s1 | Synonyms: | ME-A-N-BENZOYL-AMINO-9-DEOXY-NEU5AC | Definition date: | 2003-02-14 | Last modified: | 2020-07-17 | Identifier: | methyl 5-(acetylamino)-3,5,9-trideoxy-9-[(phenylcarbonyl)amino]-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid |
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| BNG | Name: | nonyl beta-D-glucopyranoside | Formula: | C15 H30 O6 | SMILES: | O(CCCCCCCCC)C1OC(C(O)C(O)C1O)CO | InChi: | InChI=1S/C15H30O6/c1-2-3-4-5-6-7-8-9-20-15-14(19)13(18)12(17)11(10-16)21-15/h11-19H,2-10H2,1H3/t11-,12-,13+,14-,15-/m1/s1 | Synonyms: | Beta-NONYLGLUCOSIDE | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | nonyl beta-D-glucopyranoside |
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| BNX | Name: | 2-O-phosphono-beta-D-glucopyranose | Formula: | C6 H13 O9 P | SMILES: | O=P(OC1C(O)C(O)C(OC1O)CO)(O)O | InChi: | InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(6(10)14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1 | Synonyms: | 2-O-phosphono-beta-D-glucose | Definition date: | 2014-09-18 | Last modified: | 2020-07-17 | Release date: | 2015-08-19 | Identifier: | 2-O-phosphono-beta-D-glucopyranose |
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| BO1 | Name: | N-(4-sulfamoylphenyl)-beta-D-glucopyranosylamine | Formula: | C12 H18 N2 O7 S | SMILES: | O=S(=O)(N)c1ccc(cc1)NC2OC(C(O)C(O)C2O)CO | InChi: | InChI=1S/C12H18N2O7S/c13-22(19,20)7-3-1-6(2-4-7)14-12-11(18)10(17)9(16)8(5-15)21-12/h1-4,8-12,14-18H,5H2,(H2,13,19,20)/t8-,9-,10+,11-,12-/m1/s1 | Synonyms: | N-[4-(AMINOSULFONYL)PHENYL]-BETA-D-GLUCOPYRANOSYLAMINE | Definition date: | 2006-07-12 | Last modified: | 2020-07-17 | Identifier: | N-(4-sulfamoylphenyl)-beta-D-glucopyranosylamine |
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| BOG | Name: | octyl beta-D-glucopyranoside | Formula: | C14 H28 O6 | SMILES: | O(CCCCCCCC)C1OC(C(O)C(O)C1O)CO | InChi: | InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-14-13(18)12(17)11(16)10(9-15)20-14/h10-18H,2-9H2,1H3/t10-,11-,12+,13-,14-/m1/s1 | Synonyms: | Beta-Octylglucoside | Definition date: | 1999-07-08 | Last modified: | 2020-07-17 | Identifier: | octyl beta-D-glucopyranoside |
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| 23V | Name: | N-({(2E)-2-[(3-chlorophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine | Formula: | C14 H18 Cl N3 O5 S | SMILES: | S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2cccc(Cl)c2 | InChi: | InChI=1S/C14H18ClN3O5S/c15-8-3-1-2-7(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: | 3-chlorobenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone | Definition date: | 2010-05-03 | Last modified: | 2020-07-17 | Identifier: | N-{[(2E)-2-(3-chlorobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine |
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| 24S | Name: | N-({(2Z)-2-[(2-nitrophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine | Formula: | C14 H18 N4 O7 S | SMILES: | S=C(NC1OC(C(O)C(O)C1O)CO)N/N=Cc2ccccc2[N+]([O-])=O | InChi: | InChI=1S/C14H18N4O7S/c19-6-9-10(20)11(21)12(22)13(25-9)16-14(26)17-15-5-7-3-1-2-4-8(7)18(23)24/h1-5,9-13,19-22H,6H2,(H2,16,17,26)/b15-5-/t9-,10-,11+,12-,13-/m1/s1 | Synonyms: | 2-nitrobenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone | Definition date: | 2010-05-03 | Last modified: | 2020-07-17 | Identifier: | N-{[(2Z)-2-(2-nitrobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine |
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| 25E | Name: | N-({(2Z)-2-[(4-hydroxyphenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine | Formula: | C14 H19 N3 O6 S | SMILES: | S=C(NC1OC(C(O)C(O)C1O)CO)N/N=Cc2ccc(O)cc2 | InChi: | InChI=1S/C14H19N3O6S/c18-6-9-10(20)11(21)12(22)13(23-9)16-14(24)17-15-5-7-1-3-8(19)4-2-7/h1-5,9-13,18-22H,6H2,(H2,16,17,24)/b15-5-/t9-,10-,11+,12-,13-/m1/s1 | Synonyms: | 4-hydroxybenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone | Definition date: | 2010-05-03 | Last modified: | 2020-07-17 | Identifier: | N-{[(2Z)-2-(4-hydroxybenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine |
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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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| 26O | Name: | N-({(2E)-2-[(2-hydroxyphenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine | Formula: | C14 H19 N3 O6 S | SMILES: | S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2ccccc2O | InChi: | InChI=1S/C14H19N3O6S/c18-6-9-10(20)11(21)12(22)13(23-9)16-14(24)17-15-5-7-3-1-2-4-8(7)19/h1-5,9-13,18-22H,6H2,(H2,16,17,24)/b15-5+/t9-,10-,11+,12-,13-/m1/s1 | Synonyms: | 2-hydroxybenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone | Definition date: | 2010-06-07 | Last modified: | 2020-07-17 | Identifier: | N-{[(2E)-2-(2-hydroxybenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine |
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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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