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NBY
NBY
Name:N-{[(4-nitrophenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine
Formula:C14 H17 N3 O9
SMILES:O=C(NC1OC(C(O)C(O)C1O)CO)NC(=O)c2ccc([N+]([O-])=O)cc2
InChi:InChI=1S/C14H17N3O9/c18-5-8-9(19)10(20)11(21)13(26-8)16-14(23)15-12(22)6-1-3-7(4-2-6)17(24)25/h1-4,8-11,13,18-21H,5H2,(H2,15,16,22,23)/t8-,9-,10+,11-,13-/m1/s1
Synonyms:N-{[(4-nitrophenyl)carbonyl]carbamoyl}-beta-D-glucosylamine
Definition date:2008-02-13
Last modified:2020-07-17
Identifier:N-{[(4-nitrophenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine
U97
U97
Name:2-O-sulfo-beta-L-galactopyranuronic acid
Formula:C6 H10 O10 S
SMILES:C1(C(C(=O)O)OC(O)C(C1O)OS(O)(=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
Definition date:2020-05-04
Last modified:2020-07-17
Release date:2020-07-29
Identifier:2-O-sulfo-beta-L-galactopyranuronic acid
4GL
4GL
Name:alpha-D-gulopyranose
Formula:C6 H12 O6
SMILES:OC1C(O)C(OC(O)C1O)CO
InChi:InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4-,5-,6+/m1/s1
Synonyms:alpha-D-gulose
Definition date:2011-08-18
Last modified:2020-07-17
Release date:2020-07-29
Identifier:alpha-D-gulopyranose
Z5J
Z5J
Name:beta-L-Olivopyranose
Formula:C6 H12 O4
SMILES:OC1C(OC(O)CC1O)C
InChi:InChI=1S/C6H12O4/c1-3-6(9)4(7)2-5(8)10-3/h3-9H,2H2,1H3/t3-,4-,5-,6-/m0/s1
Synonyms:beta-L-Olivose
Definition date:2012-12-18
Last modified:2020-07-17
Release date:2020-07-29
Identifier:2,6-dideoxy-beta-L-arabino-hexopyranose
S7P
S7P
Name:1-C-(hydroxymethyl)-6-O-phosphono-beta-D-altrofuranose
Formula:C7 H15 O10 P
SMILES:O=P(O)(O)OCC(O)C1OC(O)(CO)C(O)C1O
InChi:InChI=1S/C7H15O10P/c8-2-7(12)6(11)4(10)5(17-7)3(9)1-16-18(13,14)15/h3-6,8-12H,1-2H2,(H2,13,14,15)/t3-,4-,5-,6+,7-/m1/s1
Synonyms:1-C-(hydroxymethyl)-6-O-phosphono-beta-D-altrose
Definition date:2014-08-28
Last modified:2020-07-17
Release date:2015-08-12
Identifier:1-C-(hydroxymethyl)-6-O-phosphono-beta-D-altrofuranose
U9A
U9A
Name:[(2R,3R,4R,5R,6R)-2,4,5-trihydroxy-6-(sulfooxy)tetrahydro-2H-pyran-3-yl]sulfamic acid
Formula:C5 H11 N O11 S2
SMILES:C1(C(C(NS(O)(=O)=O)C(OC1OS(O)(=O)=O)O)O)O
InChi:InChI=1S/C5H11NO11S2/c7-2-1(6-18(10,11)12)4(9)16-5(3(2)8)17-19(13,14)15/h1-9H,(H,10,11,12)(H,13,14,15)/t1-,2-,3-,4-,5-/m1/s1
Definition date:2020-05-04
Last modified:2020-07-17
Release date:2020-07-29
Identifier:[(2R,3R,4R,5R,6R)-2,4,5-trihydroxy-6-(sulfooxy)tetrahydro-2H-pyran-3-yl]sulfamic acid (non-preferred name)
Z5L
Z5L
Name:methyl 2-thio-alpha-D-mannopyranoside
Formula:C7 H14 O5 S
SMILES:SC1C(O)C(O)C(OC1OC)CO
InChi:InChI=1S/C7H14O5S/c1-11-7-6(13)5(10)4(9)3(2-8)12-7/h3-10,13H,2H2,1H3/t3-,4-,5+,6+,7+/m1/s1
Definition date:2012-12-18
Last modified:2020-07-17
Release date:2020-07-29
Identifier:methyl 2-thio-alpha-D-mannopyranoside
4GP
4GP
Name:N-(carboxycarbonyl)-beta-D-glucopyranosylamine
Formula:C8 H13 N O8
SMILES:O=C(NC1OC(C(O)C(O)C1O)CO)C(=O)O
InChi:InChI=1S/C8H13NO8/c10-1-2-3(11)4(12)5(13)7(17-2)9-6(14)8(15)16/h2-5,7,10-13H,1H2,(H,9,14)(H,15,16)/t2-,3-,4+,5-,7-/m1/s1
Synonyms:N-(BETA-D-GLUCOPYRANOSYL)OXAMIC ACID
Definition date:2006-01-24
Last modified:2020-07-17
Identifier:N-(carboxycarbonyl)-beta-D-glucopyranosylamine
U9D
U9D
Name:4-deoxy-2,3,6-tri-O-methyl-alpha-D-xylo-hexopyranose
Formula:C9 H18 O5
SMILES:C1C(OC(C(C1OC)OC)O)COC
InChi:InChI=1S/C9H18O5/c1-11-5-6-4-7(12-2)8(13-3)9(10)14-6/h6-10H,4-5H2,1-3H3/t6-,7-,8+,9?/m0/s1
Definition date:2020-05-05
Last modified:2020-07-17
Release date:2020-07-29
Identifier:4-deoxy-2,3,6-tri-O-methyl-alpha-D-xylo-hexopyranose
PSV
PSV
Name:alpha-D-psicofuranose
Formula:C6 H12 O6
SMILES:OC1C(O)C(OC1(O)CO)CO
InChi:InChI=1S/C6H12O6/c7-1-3-4(9)5(10)6(11,2-8)12-3/h3-5,7-11H,1-2H2/t3-,4-,5-,6+/m1/s1
Synonyms:alpha-D-psicose
Definition date:2009-09-10
Last modified:2020-07-17
Identifier:alpha-D-psicofuranose
U9G
U9G
Name:2,3-di-O-methyl-6-O-sulfo-alpha-D-glucopyranose
Formula:C8 H16 O9 S
SMILES:OC1C(OC(C(C1OC)OC)O)COS(O)(=O)=O
InChi:InChI=1S/C8H16O9S/c1-14-6-5(9)4(3-16-18(11,12)13)17-8(10)7(6)15-2/h4-10H,3H2,1-2H3,(H,11,12,13)/t4-,5-,6+,7-,8+/m1/s1
Definition date:2020-05-05
Last modified:2020-07-17
Release date:2020-07-29
Identifier:2,3-di-O-methyl-6-O-sulfo-alpha-D-glucopyranose
Z61
Z61
Name:2-deoxy-alpha-D-arabino-hexopyranose
Formula:C6 H12 O5
SMILES:OC1C(OC(O)CC1O)CO
InChi:InChI=1S/C6H12O5/c7-2-4-6(10)3(8)1-5(9)11-4/h3-10H,1-2H2/t3-,4-,5+,6+/m1/s1
Synonyms:2-deoxy-alpha-D-glucopyranose
Definition date:2012-12-18
Last modified:2020-07-17
Release date:2020-07-29
Identifier:2-deoxy-alpha-D-arabino-hexopyranose
XIL
XIL
Name:(3S,4R)-3-hydroxy-2-oxopiperidin-4-yl beta-D-xylopyranoside
Formula:C10 H17 N O7
SMILES:O=C2NCCC(OC1OCC(O)C(O)C1O)C2O
InChi:InChI=1S/C10H17NO7/c12-4-3-17-10(8(15)6(4)13)18-5-1-2-11-9(16)7(5)14/h4-8,10,12-15H,1-3H2,(H,11,16)/t4-,5-,6+,7+,8-,10+/m1/s1
Synonyms:3-HYDROXY-4-(3,4,5-TRIHYDROXY-TETRAHYDRO-PYRAN-2-YLOXY)-PIPERIDIN-2-ONE
Definition date:2002-10-28
Last modified:2020-07-17
Identifier:(3S,4R)-3-hydroxy-2-oxopiperidin-4-yl beta-D-xylopyranoside
U9J
U9J
Name:(2R,3R,4S,5S,6R)-6-(dihydroxymethyl)-3,4-dimethoxytetrahydro-2H-pyran-2,5-diol
Formula:C8 H16 O7
SMILES:OC1C(OC(C(C1OC)OC)O)C(O)O
InChi:InChI=1S/C8H16O7/c1-13-4-3(9)5(7(10)11)15-8(12)6(4)14-2/h3-12H,1-2H3/t3-,4-,5+,6+,8+/m0/s1
Definition date:2020-05-05
Last modified:2020-07-17
Release date:2020-07-29
Identifier:(2R,3R,4S,5S,6R)-6-(dihydroxymethyl)-3,4-dimethoxytetrahydro-2H-pyran-2,5-diol (non-preferred name)
S81
S81
Name:(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl 2,6-diamino-2,4,6-trideoxy-4-fluoro-alpha-D-glucopyranoside
Formula:C12 H25 F N4 O5
SMILES:C1(C(C(O)C(F)C(CN)O1)N)OC2C(C(O)C(N)CC2N)O
InChi:InChI=1S/C12H25FN4O5/c13-6-5(2-14)21-12(7(17)9(6)19)22-11-4(16)1-3(15)8(18)10(11)20/h3-12,18-20H,1-2,14-17H2/t3-,4+,5-,6-,7-,8+,9+,10-,11-,12-/m1/s1
Synonyms:(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl 2,6-diamino-2,4,6-trideoxy-4-fluoro-alpha-D-glucoside
Definition date:2015-06-17
Last modified:2020-07-17
Release date:2016-06-22
Identifier:(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl 2,6-diamino-2,4,6-trideoxy-4-fluoro-alpha-D-glucopyranoside
U9M
U9M
Name:(2R,3R,4S,5S,6S)-6-(dihydroxymethyl)-3,4-dimethoxytetrahydro-2H-pyran-2,5-diol
Formula:C8 H16 O7
SMILES:OC1C(OC(C(C1OC)OC)O)C(O)O
InChi:InChI=1S/C8H16O7/c1-13-4-3(9)5(7(10)11)15-8(12)6(4)14-2/h3-12H,1-2H3/t3-,4-,5-,6+,8+/m0/s1
Definition date:2020-05-05
Last modified:2020-07-17
Release date:2020-07-29
Identifier:(2R,3R,4S,5S,6S)-6-(dihydroxymethyl)-3,4-dimethoxytetrahydro-2H-pyran-2,5-diol (non-preferred name)
RTG
RTG
Name:6-O-phosphono-alpha-L-idopyranose
Formula:C6 H13 O9 P
SMILES:O=P(O)(OCC1OC(C(C(C1O)O)O)O)O
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+/m0/s1
Definition date:2020-02-25
Last modified:2020-07-17
Release date:2020-07-29
Identifier:6-O-phosphono-alpha-L-idopyranose
Z6H
Z6H
Name:alpha-L-altropyranose
Formula:C6 H12 O6
SMILES:OC1C(O)C(OC(O)C1O)CO
InChi:InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4-,5+,6+/m0/s1
Synonyms:alpha-L-altrose
Definition date:2012-12-17
Last modified:2020-07-17
Release date:2019-05-15
Identifier:alpha-L-altropyranose
XXM
XXM
Name:3-C-(hydroxylmethyl)-alpha-D-erythrofuranose
Formula:C5 H10 O5
SMILES:OCC1(C(C(OC1)O)O)O
InChi:InChI=1S/C5H10O5/c6-1-5(9)2-10-4(8)3(5)7/h3-4,6-9H,1-2H2/t3-,4-,5+/m0/s1
Synonyms:alpha-D-apiose
Definition date:2016-02-24
Last modified:2020-07-17
Release date:2016-04-20
Identifier:(2S,3R,4R)-4-(hydroxymethyl)oxolane-2,3,4-triol
Z6J
Z6J
Name:alpha-L-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+/m0/s1
Synonyms:alpha-L-ribose
Definition date:2012-12-19
Last modified:2020-07-17
Release date:2014-05-28
Identifier:alpha-L-ribofuranose
Z6W
Z6W
Name:(5R)-5-[(2R)-2-hydroxynonyl]-beta-D-xylulofuranose
Formula:C14 H28 O6
SMILES:OC1C(O)C(OC1(O)CO)CC(O)CCCCCCC
InChi:InChI=1S/C14H28O6/c1-2-3-4-5-6-7-10(16)8-11-12(17)13(18)14(19,9-15)20-11/h10-13,15-19H,2-9H2,1H3/t10-,11-,12-,13+,14-/m1/s1
Definition date:2012-12-17
Last modified:2020-07-17
Release date:2020-07-29
Identifier:(5R)-5-[(2R)-2-hydroxynonyl]-beta-D-xylulofuranose
YO5
YO5
Name:(1R)-1,5-anhydro-1-(phosphonomethyl)-D-glucitol
Formula:C7 H15 O8 P
SMILES:O=P(O)(O)CC1OC(C(O)C(O)C1O)CO
InChi:InChI=1S/C7H15O8P/c8-1-3-5(9)7(11)6(10)4(15-3)2-16(12,13)14/h3-11H,1-2H2,(H2,12,13,14)/t3-,4+,5-,6+,7+/m1/s1
Synonyms:Beta-1 phosphonomethylene-D-glucopyranose
Definition date:2013-09-09
Last modified:2020-07-17
Release date:2014-07-16
Identifier:(1R)-1,5-anhydro-1-(phosphonomethyl)-D-glucitol
XXR
XXR
Name:alpha-D-rhamnopyranose
Formula:C6 H12 O5
SMILES:OC1C(O)C(OC(O)C1O)C
InChi:InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3-,4+,5+,6+/m1/s1
Synonyms:alpha-D-rhamnose
Definition date:2013-07-18
Last modified:2020-07-17
Release date:2014-02-19
Identifier:6-deoxy-alpha-D-mannopyranose
RF5
RF5
Name:2-deoxy-2-fluoro-5-O-phosphono-alpha-D-arabinofuranose
Formula:C5 H10 F O7 P
SMILES:FC1C(O)C(OC1O)COP(=O)(O)O
InChi:InChI=1S/C5H10FO7P/c6-3-4(7)2(13-5(3)8)1-12-14(9,10)11/h2-5,7-8H,1H2,(H2,9,10,11)/t2-,3+,4-,5+/m1/s1
Synonyms:Inhibitor arabinosyl-2-fluoro-2-deoxynicotinamide mononucleotide, bound form
Definition date:2008-07-30
Last modified:2020-07-17
Identifier:2-deoxy-2-fluoro-5-O-phosphono-alpha-D-arabinofuranose
XXX
XXX
Name:(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl 2,6-diamino-2,6-dideoxy-alpha-D-glucopyranoside
Formula:C12 H26 N4 O6
SMILES:O(C1C(O)C(O)C(N)CC1N)C2OC(C(O)C(O)C2N)CN
InChi:InChI=1S/C12H26N4O6/c13-2-5-8(18)9(19)6(16)12(21-5)22-11-4(15)1-3(14)7(17)10(11)20/h3-12,17-20H,1-2,13-16H2/t3-,4+,5-,6-,7+,8-,9-,10-,11-,12-/m1/s1
Synonyms:(2R,3S,4R,5R,6R)-6-((1R,2R,3S,4R,6S)-4,6-DIAMINO-2,3-DIHYDROXYCYCLOHEXYLOXY)-5-AMINO-2-(AMINOMETHYL)-TETRAHYDRO-2H-PYRA N-3,4-DIOL
Definition date:2005-11-03
Last modified:2020-07-17
Identifier:(1R,2R,3S,4R,6S)-4,6-diamino-2,3-dihydroxycyclohexyl 2,6-diamino-2,6-dideoxy-alpha-D-glucopyranoside

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数据于2025-10-15公开中

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