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7NU
7NU
表記:phenyl 6,7-anhydro-D-glycero-beta-D-galacto-heptopyranoside
組成式: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
別名:Phenyl 6,7-dideoxy-6,7-epoxy-beta-D-galacto-heptopyranoside(6D)
定義日:2016-11-28
最終更新日:2020-07-17
公開日:2017-10-11
識別子（ID）:(2~{S},3~{R},4~{S},5~{R},6~{S})-2-[(2~{R})-oxiran-2-yl]-6-phenoxy-oxane-3,4,5-triol
3LJ
3LJ
表記:2-amino-2-deoxy-6-O-sulfo-alpha-D-glucopyranose
組成式:C6 H13 N O8 S
SMILES:O=S(=O)(O)OCC1OC(O)C(N)C(O)C1O
InChi:InChI=1S/C6H13NO8S/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H,11,12,13)/t2-,3-,4-,5-,6+/m1/s1
別名:N-acetyl-6-O-sulfo-alpha-D-glucosamine
定義日:2014-09-12
最終更新日:2020-07-17
公開日:2014-11-05
識別子（ID）:2-amino-2-deoxy-6-O-sulfo-alpha-D-glucopyranose
3MG
3MG
表記:3-O-methyl-beta-D-glucopyranose
組成式:C7 H14 O6
SMILES:O(C1C(O)C(OC(O)C1O)CO)C
InChi:InChI=1S/C7H14O6/c1-12-6-4(9)3(2-8)13-7(11)5(6)10/h3-11H,2H2,1H3/t3-,4-,5-,6+,7-/m1/s1
別名:3-O-methyl-beta-D-glucose
定義日:2007-08-22
最終更新日:2020-07-17
識別子（ID）:3-O-methyl-beta-D-glucopyranose
3MK
3MK
表記:beta-L-altropyranose
組成式: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
別名:beta-L-altrose
定義日:2010-04-19
最終更新日:2020-07-17
公開日:2020-07-29
識別子（ID）:beta-L-altropyranose
3R3
3R3
表記:[[[(2R,3R,4S,5R)-3,4-bis(oxidanyl)-5-(phosphonooxymethyl)oxolan-2-yl]oxy-oxidanyl-phosphoryl]amino]phosphonic acid
組成式:C5 H14 N O13 P3
SMILES:O[CH]1[CH](O)[CH](O[CH]1CO[P](O)(O)=O)O[P](O)(=O)N[P](O)(O)=O
InChi:InChI=1S/C5H14NO13P3/c7-3-2(1-17-22(14,15)16)18-5(4(3)8)19-21(12,13)6-20(9,10)11/h2-5,7-8H,1H2,(H2,14,15,16)(H4,6,9,10,11,12,13)/t2-,3-,4-,5-/m1/s1
定義日:2014-10-13
最終更新日:2020-07-17
公開日:2015-12-23
識別子（ID）:[[[(2R,3R,4S,5R)-3,4-bis(oxidanyl)-5-(phosphonooxymethyl)oxolan-2-yl]oxy-oxidanyl-phosphoryl]amino]phosphonic acid
3S6
3S6
表記:prop-2-en-1-yl beta-D-galactofuranoside
組成式:C9 H16 O6
SMILES:O(C/C=C)C1OC(C(O)C1O)C(O)CO
InChi:InChI=1S/C9H16O6/c1-2-3-14-9-7(13)6(12)8(15-9)5(11)4-10/h2,5-13H,1,3-4H2/t5-,6-,7-,8+,9-/m1/s1
別名:prop-2-en-1-yl beta-D-galactoside
定義日:2014-10-16
最終更新日:2020-07-17
公開日:2015-07-01
識別子（ID）:prop-2-en-1-yl beta-D-galactofuranoside
3SA
3SA
表記:ACARBOSE DERIVED TRISACCHARIDE
組成式:C19 H33 N O13
SMILES:OC3C(OC2OC(C)C(NC1C=C(CO)C(O)C(O)C1O)C(O)C2O)C(OC(O)C3O)CO
InChi:InChI=1S/C19H33NO13/c1-5-9(20-7-2-6(3-21)10(23)13(26)11(7)24)12(25)16(29)19(31-5)33-17-8(4-22)32-18(30)15(28)14(17)27/h2,5,7-30H,3-4H2,1H3/t5-,7+,8-,9-,10-,11+,12+,13+,14-,15-,16-,17-,18+,19-/m1/s1
別名:4-O-(4,6-DIDEOXY-4-{[4,5,6-TRIHYDROXY-3-(HYDROXYMETHYL)CYCLOHEX-2-EN-1-YL]AMINO}-BETA-D-LYXO-HEXOPYRANOSYL)-ALPHA-D-ERY THRO-HEXOPYRANOSE
定義日:2004-09-15
最終更新日:2020-07-17
識別子（ID）:4-O-(4,6-dideoxy-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}-alpha-D-glucopyranosyl)-alpha-D-glucopyranose
3YW
3YW
表記:(2S)-2,3-dihydroxypropyl 2-acetamido-2-deoxy-alpha-D-glucopyranoside
組成式:C11 H21 N O8
SMILES:O=C(NC1C(O)C(O)C(OC1OCC(O)CO)CO)C
InChi:InChI=1S/C11H21NO8/c1-5(15)12-8-10(18)9(17)7(3-14)20-11(8)19-4-6(16)2-13/h6-11,13-14,16-18H,2-4H2,1H3,(H,12,15)/t6-,7+,8+,9+,10+,11-/m0/s1
別名:(2S)-2,3-dihydroxypropyl 2-(acetylamino)-2-deoxy-alpha-D-glucopyranoside
定義日:2014-12-10
最終更新日:2020-07-17
公開日:2015-02-25
識別子（ID）:(2S)-2,3-dihydroxypropyl 2-(acetylamino)-2-deoxy-alpha-D-glucopyranoside
9C1
9C1
表記:2-{[(2E)-4-chlorobut-2-enoyl]amino}-2-deoxy-beta-D-glucopyranose
組成式:C10 H16 Cl N O6
SMILES:C(=C/CCl)C(=O)NC1C(C(C(CO)OC1O)O)O
InChi:InChI=1S/C10H16ClNO6/c11-3-1-2-6(14)12-7-9(16)8(15)5(4-13)18-10(7)17/h1-2,5,7-10,13,15-17H,3-4H2,(H,12,14)/b2-1+/t5-,7-,8-,9-,10-/m1/s1
別名:2-{[(2E)-4-chlorobut-2-enoyl]amino}-2-deoxy-beta-D-glucose
定義日:2017-04-18
最終更新日:2020-07-17
公開日:2017-10-18
識別子（ID）:2-{[(2E)-4-chlorobut-2-enoyl]amino}-2-deoxy-beta-D-glucopyranose
9CD
9CD
表記:2-{[(2E)-but-2-enoyl]amino}-2-deoxy-beta-D-glucopyranose
組成式: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
別名:2-{[(2E)-but-2-enoyl]amino}-2-deoxy-beta-D-glucose
定義日:2017-04-18
最終更新日:2020-07-17
公開日:2017-10-18
識別子（ID）:2-{[(2E)-but-2-enoyl]amino}-2-deoxy-beta-D-glucopyranose
9GP
9GP
表記:N-(hydroxyacetyl)-beta-D-glucopyranosylamine
組成式: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
別名:N-(hydroxyacetyl)-beta-D-glucosylamine
定義日:2009-02-05
最終更新日:2020-07-17
識別子（ID）:N-(hydroxyacetyl)-beta-D-glucopyranosylamine
9KJ
9KJ
表記:{[(2R,3R,4R,5R)-3-(alpha-D-glucopyranosyloxy)-4-hydroxy-2,5-bis(hydroxymethyl)pyrrolidin-1-yl]methyl}phosphonic acid
組成式: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
別名:{[(2R,3R,4R,5R)-3-(alpha-D-glucosyloxy)-4-hydroxy-2,5-bis(hydroxymethyl)pyrrolidin-1-yl]methyl}phosphonic acid
定義日:2017-05-17
最終更新日:2020-07-17
公開日:2017-06-07
識別子（ID）:{[(2R,3R,4R,5R)-3-(alpha-D-glucopyranosyloxy)-4-hydroxy-2,5-bis(hydroxymethyl)pyrrolidin-1-yl]methyl}phosphonic acid
B9D
B9D
表記:5-fluoro-alpha-L-idopyranose
組成式:C6 H11 F O6
SMILES:FC1(OC(O)C(O)C(O)C1O)CO
InChi:InChI=1S/C6H11FO6/c7-6(1-8)4(11)2(9)3(10)5(12)13-6/h2-5,8-12H,1H2/t2-,3-,4+,5-,6+/m1/s1
別名:(2R,3R,4R,5S,6R)-6-fluoranyl-6-(hydroxymethyl)oxane-2,3,4,5-tetrol
定義日:2009-08-18
最終更新日:2020-07-17
識別子（ID）:(2R,3R,4R,5S,6R)-6-fluoro-6-(hydroxymethyl)tetrahydro-2H-pyran-2,3,4,5-tetrol (non-preferred name)
BBK
BBK
表記:2-acetamido-2-deoxy-5-thio-alpha-D-galactopyranose
組成式:C8 H15 N O5 S
SMILES:C1(O)C(C(O)C(C(S1)CO)O)NC(C)=O
InChi:InChI=1S/C8H15NO5S/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5-,6+,7-,8+/m1/s1
別名:2-(acetylamino)-2-deoxy-5-thio-alpha-D-galactopyranose
定義日:2014-04-30
最終更新日:2020-07-17
公開日:2014-05-28
識別子（ID）:2-(acetylamino)-2-deoxy-5-thio-alpha-D-galactopyranose
BBV
BBV
表記:benzyl 2-acetamido-2-deoxy-alpha-D-glucopyranoside
組成式:C15 H21 N O6
SMILES:O=C(NC2C(O)C(O)C(OC2OCc1ccccc1)CO)C
InChi:InChI=1S/C15H21NO6/c1-9(18)16-12-14(20)13(19)11(7-17)22-15(12)21-8-10-5-3-2-4-6-10/h2-6,11-15,17,19-20H,7-8H2,1H3,(H,16,18)/t11-,12-,13-,14-,15+/m1/s1
別名:benzyl 2-(acetylamino)-2-deoxy-alpha-D-glucopyranoside
定義日:2012-04-09
最終更新日:2020-07-17
識別子（ID）:benzyl 2-(acetylamino)-2-deoxy-alpha-D-glucopyranoside
BCD
BCD
表記:BETA-CYCLODEXTRIN
組成式:C42 H70 O35
SMILES:O1C8C(O)C(O)C(OC7C(O)C(O)C(OC6C(O)C(O)C(OC5C(O)C(O)C(OC4C(O)C(O)C(OC3C(O)C(O)C(OC2C(OC1C(O)C2O)CO)OC3CO)OC4CO)OC5CO)OC6CO)OC7CO)OC8CO
InChi:InChI=1S/C42H70O35/c43-1-8-29-15(50)22(57)36(64-8)72-30-9(2-44)66-38(24(59)17(30)52)74-32-11(4-46)68-40(26(61)19(32)54)76-34-13(6-48)70-42(28(63)21(34)56)77-35-14(7-49)69-41(27(62)20(35)55)75-33-12(5-47)67-39(25(60)18(33)53)73-31-10(3-45)65-37(71-29)23(58)16(31)51/h8-63H,1-7H2/t8-,9-,10-,11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-/m1/s1
別名:CYCLO-HEPTA-AMYLOSE
定義日:1999-07-08
最終更新日:2020-07-17
識別子（ID）:(1S,3R,5R,6S,8R,10R,11S,13R,15R,16S,18R,20R,21S,23R,25R,26S,28R,30R,31S,33R,35R,36R,37R,38R,39R,40R,41R,42R,43R,44R,45R,46R,47R,48R,49R)-5,10,15,20,25,30,35-heptakis(hydroxymethyl)-2,4,7,9,12,14,17,19,22,24,27,29,32,34-tetradecaoxaoctacyclo[31.2.2.2~3,6~.2~8,11~.2~13,16~.2~18,21~.2~23,26~.2~28,31~]nonatetracontane-36,37,38,39,40,41,42,43,44,45,46,47,48,49-tetradecol (non-preferred name)
BCW
BCW
表記:6-deoxy-alpha-L-galactopyranosyl-(1->4)-[6-deoxy-alpha-L-galactopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->3)]-2-(ace tylamino)-2-deoxy-alpha-D-glucopyranose
組成式:C26 H45 N O19
SMILES:C[CH]1O[CH](O[CH]2[CH](O)[CH](O)[CH](CO)O[CH]2O[CH]3[CH](NC(C)=O)[CH](O)O[CH](CO)[CH]3O[CH]4O[CH](C)[CH](O)[CH](O)[CH]4O)[CH](O)[CH](O)[CH]1O
InChi:InChI=1S/C26H45NO19/c1-6-12(31)15(34)18(37)24(40-6)44-20-10(5-29)42-23(39)11(27-8(3)30)21(20)45-26-22(17(36)14(33)9(4-28)43-26)46-25-19(38)16(35)13(32)7(2)41-25/h6-7,9-26,28-29,31-39H,4-5H2,1-3H3,(H,27,30)/t6-,7-,9+,10+,11+,12+,13+,14-,15+,16+,17-,18-,19-,20+,21+,22+,23-,24-,25-,26-/m0/s1
定義日:2010-01-26
最終更新日:2020-07-17
識別子（ID）:N-[(2S,3R,4R,5S,6R)-4-[(2R,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-oxan-2-yl]oxy-2-hydroxy-6-(hydroxymethyl)-5-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-oxan-3-yl]ethanamide
BDG
BDG
表記:2,6-diamino-2,6-dideoxy-alpha-D-glucopyranose
組成式:C6 H14 N2 O4
SMILES:OC1C(O)C(OC(O)C1N)CN
InChi:InChI=1S/C6H14N2O4/c7-1-2-4(9)5(10)3(8)6(11)12-2/h2-6,9-11H,1,7-8H2/t2-,3-,4-,5-,6+/m1/s1
別名:O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-D-GLUCOPYRANOSE
定義日:1999-07-08
最終更新日:2020-07-17
識別子（ID）:2,6-diamino-2,6-dideoxy-alpha-D-glucopyranose
BDP
BDP
表記:beta-D-glucopyranuronic acid
組成式:C6 H10 O7
SMILES:O=C(O)C1OC(O)C(O)C(O)C1O
InChi:InChI=1S/C6H10O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,6-9,12H,(H,10,11)/t1-,2-,3+,4-,6+/m0/s1
別名:beta-D-glucuronic acid
定義日:2001-11-26
最終更新日:2020-07-17
識別子（ID）:beta-D-glucopyranuronic acid
BDR
BDR
表記:beta-D-ribofuranose
組成式: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-/m1/s1
別名:beta-D-ribose
定義日:1999-07-08
最終更新日:2020-07-17
識別子（ID）:beta-D-ribofuranose
BDZ
BDZ
表記:6-deoxy-alpha-L-galactopyranosyl-(1->3)-[6-deoxy-alpha-L-galactopyranosyl-(1->2)-beta-D-galactopyranosyl-(1->4)]-2-(ace tylamino)-2-deoxy-beta-D-glucopyranose
組成式:C26 H45 N O19
SMILES:C[CH]1O[CH](O[CH]2[CH](O)[CH](O)[CH](CO)O[CH]2O[CH]3[CH](CO)O[CH](O)[CH](NC(C)=O)[CH]3O[CH]4O[CH](C)[CH](O)[CH](O)[CH]4O)[CH](O)[CH](O)[CH]1O
InChi:InChI=1S/C26H45NO19/c1-6-12(31)15(34)18(37)24(40-6)45-21-11(27-8(3)30)23(39)42-10(5-29)20(21)44-26-22(17(36)14(33)9(4-28)43-26)46-25-19(38)16(35)13(32)7(2)41-25/h6-7,9-26,28-29,31-39H,4-5H2,1-3H3,(H,27,30)/t6-,7-,9+,10+,11+,12+,13+,14-,15+,16+,17-,18-,19-,20+,21+,22+,23+,24-,25-,26-/m0/s1
定義日:2010-01-26
最終更新日:2020-07-17
識別子（ID）:N-[(2R,3R,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-oxan-2-yl]oxy-2-hydroxy-6-(hydroxymethyl)-4-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl]oxy-oxan-3-yl]ethanamide
BEM
BEM
表記:beta-D-mannopyranuronic acid
組成式:C6 H10 O7
SMILES:O=C(O)C1OC(O)C(O)C(O)C1O
InChi:InChI=1S/C6H10O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,6-9,12H,(H,10,11)/t1-,2-,3-,4-,6+/m0/s1
別名:beta-D-mannuronic acid
定義日:2007-11-05
最終更新日:2020-07-17
識別子（ID）:beta-D-mannopyranuronic acid
BG8
BG8
表記:2-(benzoylamino)-2-deoxy-beta-D-glucopyranose
組成式:C13 H17 N O6
SMILES:C2(C(NC(c1ccccc1)=O)C(OC(C2O)CO)O)O
InChi:InChI=1S/C13H17NO6/c15-6-8-10(16)11(17)9(13(19)20-8)14-12(18)7-4-2-1-3-5-7/h1-5,8-11,13,15-17,19H,6H2,(H,14,18)/t8-,9-,10-,11-,13-/m1/s1
別名:N-benzoyl-beta-D-glucosamine
定義日:2015-06-02
最終更新日:2020-07-17
公開日:2015-06-17
識別子（ID）:2-(benzoylamino)-2-deoxy-beta-D-glucopyranose
BGC
BGC
表記:beta-D-glucopyranose
組成式: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
別名:beta-D-glucose
定義日:2002-01-22
最終更新日:2020-07-17
識別子（ID）:beta-D-glucopyranose
BGL
BGL
表記:2-O-octyl-beta-D-glucopyranose
組成式:C14 H28 O6
SMILES:O(CCCCCCCC)C1C(O)C(O)C(OC1O)CO
InChi:InChI=1S/C14H28O6/c1-2-3-4-5-6-7-8-19-13-12(17)11(16)10(9-15)20-14(13)18/h10-18H,2-9H2,1H3/t10-,11-,12+,13-,14-/m1/s1
別名:2-O-octyl-beta-D-glucose
定義日:1999-07-08
最終更新日:2020-07-17
識別子（ID）:2-O-octyl-beta-D-glucopyranose

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