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KDE
KDE
Name:prop-2-en-1-yl 3-deoxy-beta-L-gulo-oct-2-ulopyranosidonic acid
Formula:C11 H18 O8
SMILES:O=C(O)C1(OCC=C)OC(C(O)CO)C(O)C(O)C1
InChi:InChI=1S/C11H18O8/c1-2-3-18-11(10(16)17)4-6(13)8(15)9(19-11)7(14)5-12/h2,6-9,12-15H,1,3-5H2,(H,16,17)/t6-,7+,8-,9-,11-/m1/s1
Synonyms:ALPHA-7-EPI-(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-2-O-ALLYL
Definition date:2008-01-18
Last modified:2020-07-17
Identifier:prop-2-en-1-yl 3-deoxy-beta-L-gulo-oct-2-ulopyranosidonic acid
KDM
KDM
Name:deamino-alpha-neuraminic acid
Formula:C9 H16 O9
SMILES:OC[CH](O)[CH](O)[CH]1O[C](O)(C[CH](O)[CH]1O)C(O)=O
InChi:InChI=1S/C9H16O9/c10-2-4(12)6(14)7-5(13)3(11)1-9(17,18-7)8(15)16/h3-7,10-14,17H,1-2H2,(H,15,16)/t3-,4+,5+,6+,7+,9+/m0/s1
Synonyms:alpha-deaminoneuraminic acid
Definition date:2010-11-26
Last modified:2020-07-17
Identifier:(2R,4S,5R,6R)-2,4,5-trihydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
KDN
KDN
Name:deamino-beta-neuraminic acid
Formula:C9 H16 O9
SMILES:O=C(O)C1(O)OC(C(O)C(O)CO)C(O)C(O)C1
InChi:InChI=1S/C9H16O9/c10-2-4(12)6(14)7-5(13)3(11)1-9(17,18-7)8(15)16/h3-7,10-14,17H,1-2H2,(H,15,16)/t3-,4+,5+,6+,7+,9-/m0/s1
Synonyms:beta-deaminoneuraminic acid
Definition date:2008-09-18
Last modified:2020-07-17
Identifier:3-deoxy-D-glycero-beta-D-galacto-non-2-ulopyranosonic acid
KDO
KDO
Name:3-deoxy-alpha-D-manno-oct-2-ulopyranosonic acid
Formula:C8 H14 O8
SMILES:O=C(O)C1(O)OC(C(O)CO)C(O)C(O)C1
InChi:InChI=1S/C8H14O8/c9-2-4(11)6-5(12)3(10)1-8(15,16-6)7(13)14/h3-6,9-12,15H,1-2H2,(H,13,14)/t3-,4-,5-,6-,8-/m1/s1
Synonyms:3-deoxy-d-manno-oct-2-ulopyranosonic acid
Definition date:1999-07-08
Last modified:2020-07-17
Identifier:3-deoxy-alpha-D-manno-oct-2-ulopyranosonic acid
KDR
KDR
Name:prop-2-en-1-yl 3-deoxy-alpha-D-manno-octos-2-ulopyranoside
Formula:C11 H18 O7
SMILES:O=CC1(OCC=C)OC(C(O)CO)C(O)C(O)C1
InChi:InChI=1S/C11H18O7/c1-2-3-17-11(6-13)4-7(14)9(16)10(18-11)8(15)5-12/h2,6-10,12,14-16H,1,3-5H2/t7-,8-,9-,10-,11-/m1/s1
Synonyms:prop-2-en-1-yl 3-deoxy-alpha-D-manno-octos-2-uloside
Definition date:2008-01-14
Last modified:2020-07-17
Identifier:prop-2-en-1-yl 3-deoxy-alpha-D-manno-octos-2-ulopyranoside
KFN
KFN
Name:2,6-anhydro-3-deoxy-D-glycero-D-galacto-non-2-enonic acid
Formula:C9 H14 O8
SMILES:OC[CH](O)[CH](O)[CH]1OC(=C[CH](O)[CH]1O)C(O)=O
InChi:InChI=1S/C9H14O8/c10-2-4(12)7(14)8-6(13)3(11)1-5(17-8)9(15)16/h1,3-4,6-8,10-14H,2H2,(H,15,16)/t3-,4+,6+,7+,8+/m0/s1
Synonyms:(4S,5R,6R)-4,5-DIHYDROXY-6-[(1R,2R)-1,2,3-TRIHYDROXYPROPYL]-5,6-DIHYDRO-4H-PYRAN-2-CARBOXYLIC ACID
Definition date:2010-11-26
Last modified:2020-07-17
Identifier:(4S,5R,6R)-4,5-dihydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-5,6-dihydro-4H-pyran-2-carboxylic acid
KG1
KG1
Name:propadienyl 6-deoxy-alpha-L-galactopyranoside
Formula:C9 H14 O5
SMILES:C[CH]1O[CH](O[CH]=[C]=[CH2])[CH](O)[CH](O)[CH]1O
InChi:InChI=1S/C9H14O5/c1-3-4-13-9-8(12)7(11)6(10)5(2)14-9/h4-12H,1H2,2H3/t5-,6+,7+,8-,9+/m0/s1
Synonyms:propargyl-fucoside
Definition date:2017-12-04
Last modified:2020-07-17
Release date:2018-01-31
Identifier:(2~{S},3~{S},4~{R},5~{S},6~{R})-2-methyl-6-propa-1,2-dienoxy-oxane-3,4,5-triol
KGM
KGM
Name:heptyl alpha-D-mannopyranoside
Formula:C13 H26 O6
SMILES:O(CCCCCCC)C1OC(C(O)C(O)C1O)CO
InChi:InChI=1S/C13H26O6/c1-2-3-4-5-6-7-18-13-12(17)11(16)10(15)9(8-14)19-13/h9-17H,2-8H2,1H3/t9-,10-,11+,12+,13+/m1/s1
Synonyms:Heptyl Alpha-D-mannopyrannoside
Definition date:2013-06-23
Last modified:2020-07-17
Release date:2014-02-12
Identifier:heptyl alpha-D-mannopyranoside
KHP
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
FMO
FMO
Name:2-deoxy-2,2-difluoro-4-O-alpha-D-glucopyranosyl-alpha-D-arabino-hexopyranosyl fluoride
Formula:C12 H19 F3 O9
SMILES:FC2(F)C(O)C(OC1OC(C(O)C(O)C1O)CO)C(OC2F)CO
InChi:InChI=1S/C12H19F3O9/c13-11-12(14,15)9(21)8(4(2-17)23-11)24-10-7(20)6(19)5(18)3(1-16)22-10/h3-11,16-21H,1-2H2/t3-,4-,5-,6+,7-,8-,9+,10-,11+/m1/s1
Synonyms:1,2,2-trifluoromaltose
Definition date:2014-07-24
Last modified:2020-07-17
Release date:2015-07-22
Identifier:2-deoxy-2,2-difluoro-4-O-alpha-D-glucopyranosyl-alpha-D-arabino-hexopyranosyl fluoride
FNG
FNG
Name:5-aminocarbonyl-3-nitrophenyl alpha-D-galactopyranoside
Formula:C13 H16 N2 O9
SMILES:[O-][N+](=O)c2cc(OC1OC(C(O)C(O)C1O)CO)cc(C(=O)N)c2
InChi:InChI=1S/C13H16N2O9/c14-12(20)5-1-6(15(21)22)3-7(2-5)23-13-11(19)10(18)9(17)8(4-16)24-13/h1-3,8-11,13,16-19H,4H2,(H2,14,20)/t8-,9+,10+,11-,13+/m1/s1
Synonyms:5-AMINOCARBONYL-3-NITROPHENYL-ALPHA-D-GALACTOPYRANOSE
Definition date:2002-05-09
Last modified:2020-07-17
Identifier:3-(alpha-D-galactopyranosyloxy)-5-nitrobenzamide
FNY
FNY
Name:1-FRUCTOFURANOSYL-D-NYSTOSE
Formula:C30 H52 O26
SMILES:OC[CH]1O[CH](O[C]2(CO[C]3(CO[C]4(CO[C]5(CO)O[CH](CO)[CH](O)[CH]5O)O[CH](CO)[CH](O)[CH]4O)O[CH](CO)[CH](O)[CH]3O)O[CH](CO)[CH](O)[CH]2O)[CH](O)[CH](O)[CH]1O
InChi:InChI=1S/C30H52O26/c31-1-10-15(37)20(42)21(43)26(51-10)56-30(25(47)19(41)14(5-35)55-30)9-50-29(24(46)18(40)13(4-34)54-29)8-49-28(23(45)17(39)12(3-33)53-28)7-48-27(6-36)22(44)16(38)11(2-32)52-27/h10-26,31-47H,1-9H2/t10-,11+,12+,13+,14+,15+,16+,17+,18+,19-,20+,21+,22-,23-,24-,25+,26+,27+,28+,29+,30-/m0/s1
Definition date:2016-06-10
Last modified:2020-07-17
Release date:2017-01-18
Identifier:(2R,3R,4R,5S,6S)-2-[(2S,3R,4R,5R)-2-[[(2R,3S,4S,5R)-2-[[(2R,3S,4S,5R)-2-[[(2R,3S,4S,5R)-2,5-bis(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethyl]-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethyl]-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxymethyl]-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol
FSA
FSA
Name:1-S-(carboxymethyl)-1-thio-beta-D-fructopyranose
Formula:C8 H14 O7 S
SMILES:O=C(O)CSCC1(O)OCC(O)C(O)C1O
InChi:InChI=1S/C8H14O7S/c9-4-1-15-8(14,7(13)6(4)12)3-16-2-5(10)11/h4,6-7,9,12-14H,1-3H2,(H,10,11)/t4-,6-,7+,8-/m1/s1
Synonyms:1-S-(carboxymethyl)-1-thio-beta-D-fructose
Definition date:2008-06-24
Last modified:2020-07-17
Identifier:1-S-(carboxymethyl)-1-thio-beta-D-fructopyranose
FSI
FSI
Name:5-acetamido-3,5-dideoxy-3-fluoro-D-erythro-alpha-L-manno-non-2-ulopyranosonic acid
Formula:C11 H18 F N O9
SMILES:O=C(O)C1(O)OC(C(NC(=O)C)C(O)C1F)C(O)C(O)CO
InChi:InChI=1S/C11H18FNO9/c1-3(15)13-5-7(18)9(12)11(21,10(19)20)22-8(5)6(17)4(16)2-14/h4-9,14,16-18,21H,2H2,1H3,(H,13,15)(H,19,20)/t4-,5-,6-,7-,8-,9-,11+/m1/s1
Synonyms:5-(acetylamino)-3,5-dideoxy-3-fluoro-D-erythro-alpha-L-manno-non-2-ulopyranosonic acid
Definition date:2004-01-19
Last modified:2020-07-17
Identifier:5-(acetylamino)-3,5-dideoxy-3-fluoro-D-erythro-alpha-L-manno-non-2-ulopyranosonic acid
FSM
FSM
Name:FORSMANN ANTIGEN
Formula:C16 H28 N2 O11
SMILES:O=C(NC2C(OC1OC(C(O)C(O)C1NC(=O)C)CO)C(O)C(OC2O)CO)C
InChi:InChI=1S/C16H28N2O11/c1-5(21)17-9-13(25)11(23)7(3-19)28-16(9)29-14-10(18-6(2)22)15(26)27-8(4-20)12(14)24/h7-16,19-20,23-26H,3-4H2,1-2H3,(H,17,21)(H,18,22)/t7-,8-,9-,10-,11+,12+,13-,14-,15-,16-/m1/s1
Synonyms:2-(ACETYLAMINO)-3-O-[2-(ACETYLAMINO)-2-DEOXY-ALPHA-L-GALACTOPYRANOSYL]-2-DEOXY-BETA-L-GALACTOPYRANOSE
Definition date:2006-10-19
Last modified:2020-07-17
Identifier:2-(acetylamino)-3-O-[2-(acetylamino)-2-deoxy-alpha-D-galactopyranosyl]-2-deoxy-beta-D-galactopyranose
FSR
FSR
Name:(2S,3S,4R,5R,6R)-5-acetamido-2,3-bis(fluoranyl)-4-oxidanyl-6-[(1S,2S)-1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic acid
Formula:C11 H17 F2 N O8
SMILES:FC1(OC(C(NC(=O)C)C(O)C1F)C(O)C(O)CO)C(=O)O
InChi:InChI=1S/C11H17F2NO8/c1-3(16)14-5-7(19)9(12)11(13,10(20)21)22-8(5)6(18)4(17)2-15/h4-9,15,17-19H,2H2,1H3,(H,14,16)(H,20,21)/t4-,5+,6-,7+,8+,9-,11+/m0/s1
Synonyms:2,3-difluorosialic acid
Definition date:2013-10-28
Last modified:2020-07-17
Release date:2013-12-25
Identifier:(2R,3S,4R,5R,6R)-5-(acetylamino)-2,3-difluoro-4-hydroxy-6-[(1S,2S)-1,2,3-trihydroxypropyl]tetrahydro-2H-pyran-2-carboxy lic acid (non-preferred name)
0HX
0HX
Name:pentan-3-yl 2-acetamido-2,4-dideoxy-alpha-L-threo-hex-4-enopyranosiduronic acid
Formula:C13 H21 N O6
SMILES:CCC(CC)O[CH]1OC(=C[CH](O)[CH]1NC(C)=O)C(O)=O
InChi:InChI=1S/C13H21NO6/c1-4-8(5-2)19-13-11(14-7(3)15)9(16)6-10(20-13)12(17)18/h6,8-9,11,13,16H,4-5H2,1-3H3,(H,14,15)(H,17,18)/t9-,11+,13+/m0/s1
Synonyms:pentan-3-yl 2-(acetylamino)-2,4-dideoxy-alpha-L-threo-hex-4-enopyranosiduronic acid
Definition date:2012-01-19
Last modified:2020-07-17
Release date:2013-02-08
Identifier:(2~{R},3~{R},4~{S})-3-acetamido-4-oxidanyl-2-pentan-3-yloxy-3,4-dihydro-2~{H}-pyran-6-carboxylic acid
FVQ
FVQ
Name:3-(pyridin-3-yl)prop-2-yn-1-yl alpha-D-mannopyranoside
Formula:C14 H17 N O6
SMILES:C(#Cc1cccnc1)COC2OC(C(O)C(O)C2O)CO
InChi:InChI=1S/C14H17NO6/c16-8-10-11(17)12(18)13(19)14(21-10)20-6-2-4-9-3-1-5-15-7-9/h1,3,5,7,10-14,16-19H,6,8H2/t10-,11-,12+,13+,14+/m1/s1
Synonyms:3-pyridin-3-ylprop-2-yn-1-yl alpha-D-mannopyranoside
Definition date:2012-05-23
Last modified:2020-07-17
Identifier:3-(pyridin-3-yl)prop-2-yn-1-yl alpha-D-mannopyranoside
0LP
0LP
Name:5-acetamido-2,6-anhydro-3,5-dideoxy-3-[(2E)-3-phenylprop-2-en-1-yl]-D-glycero-L-altro-non-2-enonic acid
Formula:C20 H25 N O8
SMILES:CC(=O)NC1C(O)C(=C(OC1C(O)C(O)CO)C(O)=O)C[C@H]=Cc2ccccc2
InChi:InChI=1S/C20H25NO8/c1-11(23)21-15-16(25)13(9-5-8-12-6-3-2-4-7-12)18(20(27)28)29-19(15)17(26)14(24)10-22/h2-8,14-17,19,22,24-26H,9-10H2,1H3,(H,21,23)(H,27,28)/b8-5+/t14-,15-,16+,17+,19-/m1/s1
Synonyms:5-(acetylamino)-2,6-anhydro-3,5-dideoxy-3-[(2E)-3-phenylprop-2-en-1-yl]-D-glycero-L-altro-non-2-enonic acid
Definition date:2012-08-16
Last modified:2020-07-17
Release date:2012-09-21
Identifier:5-(acetylamino)-2,6-anhydro-3,5-dideoxy-3-[(2E)-3-phenylprop-2-en-1-yl]-D-glycero-L-altro-non-2-enonic acid
FYJ
FYJ
Name:phenyl 1-thio-beta-D-glucopyranosiduronic acid
Formula:C12 H14 O6 S
SMILES:C(C1OC(C(C(C1O)O)O)Sc2ccccc2)(=O)O
InChi:InChI=1S/C12H14O6S/c13-7-8(14)10(11(16)17)18-12(9(7)15)19-6-4-2-1-3-5-6/h1-5,7-10,12-15H,(H,16,17)/t7-,8-,9+,10-,12-/m0/s1
Synonyms:phenyl 1-thio-beta-D-glucosiduronic acid
Definition date:2018-04-25
Last modified:2020-07-17
Release date:2018-10-17
Identifier:phenyl 1-thio-beta-D-glucopyranosiduronic acid
0NZ
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
G0S
G0S
Name:3-(beta-D-galactopyranosylthio)propanoic acid
Formula:C9 H16 O7 S
SMILES:O=C(O)CCSC1OC(C(O)C(O)C1O)CO
InChi:InChI=1S/C9H16O7S/c10-3-4-6(13)7(14)8(15)9(16-4)17-2-1-5(11)12/h4,6-10,13-15H,1-3H2,(H,11,12)/t4-,6+,7+,8-,9+/m1/s1
Synonyms:3-(beta-D-galactosylthio)propanoic acid
Definition date:2011-08-23
Last modified:2020-07-17
Identifier:3-(beta-D-galactopyranosylthio)propanoic acid
G16
G16
Name:1,6-di-O-phosphono-alpha-D-glucopyranose
Formula:C6 H13 O12 P2
SMILES:O=P([O-])(OC1OC(C(O)C(O)C1O)COP(=O)(O)O)O
InChi:InChI=1S/C6H14O12P2/c7-3-2(1-16-19(10,11)12)17-6(5(9)4(3)8)18-20(13,14)15/h2-9H,1H2,(H2,10,11,12)(H2,13,14,15)/p-1/t2-,3-,4+,5-,6-/m1/s1
Synonyms:ALPHA-D-GLUCOSE 1,6-BISPHOSPHATE
Definition date:1999-08-11
Last modified:2020-07-17
Identifier:1-O-(hydroxyphosphinato)-6-O-phosphono-alpha-D-glucopyranose
I57
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
0TS
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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數據於2024-07-17公開中

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