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8GG

8GG
Name:	5-Se-methyl-5-seleno-beta-D-ribofuranose
Formula:	C6 H12 O4 Se
SMILES:	O1C(C[Se]C)C(C(C1O)O)O
InChi:	InChI=1S/C6H12O4Se/c1-11-2-3-4(7)5(8)6(9)10-3/h3-9H,2H2,1H3/t3-,4-,5-,6-/m1/s1
Synonyms:	5-Se-methyl-5-seleno-beta-D-ribose
Definition date:	2017-02-04
Last modified:	2020-07-17
Release date:	2018-09-12
Identifier:	5-Se-methyl-5-seleno-beta-D-ribofuranose

8GP

8GP
Name:	N-[(cyclopropylamino)(oxo)acetyl]-beta-D-glucopyranosylamine
Formula:	C11 H18 N2 O7
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)C(=O)NC2CC2
InChi:	InChI=1S/C11H18N2O7/c14-3-5-6(15)7(16)8(17)11(20-5)13-10(19)9(18)12-4-1-2-4/h4-8,11,14-17H,1-3H2,(H,12,18)(H,13,19)/t5-,6-,7+,8-,11-/m1/s1
Synonyms:	N-(BETA-D-GLUCOPYRANOSYL)-N'-CYCLOPROPYL OXALAMIDE
Definition date:	2006-01-25
Last modified:	2020-07-17
Identifier:	N-[(cyclopropylamino)(oxo)acetyl]-beta-D-glucopyranosylamine

8LM

8LM
Name:	2,6-anhydro-3,5-dideoxy-5-[(2-methylpropanoyl)amino]-3-(4-phenyl-1H-1,2,3-triazol-1-yl)-D-glycero-D-galacto-non-2-enoni c acid
Formula:	C21 H26 N4 O8
SMILES:	C(=O)(NC1C(O)C(=C(C(O)=O)OC1C(C(CO)O)O)n3cc(c2ccccc2)nn3)C(C)C
InChi:	InChI=1S/C21H26N4O8/c1-10(2)20(30)22-14-17(29)15(19(21(31)32)33-18(14)16(28)13(27)9-26)25-8-12(23-24-25)11-6-4-3-5-7-11/h3-8,10,13-14,16-18,26-29H,9H2,1-2H3,(H,22,30)(H,31,32)/t13-,14-,16-,17-,18-/m1/s1
Definition date:	2017-02-15
Last modified:	2020-07-17
Release date:	2018-06-27
Identifier:	2,6-anhydro-3,5-dideoxy-5-[(2-methylpropanoyl)amino]-3-(4-phenyl-1H-1,2,3-triazol-1-yl)-D-glycero-D-galacto-non-2-enoni c acid

8LR

8LR
Name:	2-hydroxyethyl alpha-D-mannopyranoside
Formula:	C8 H16 O7
SMILES:	O(CCO)C1OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C8H16O7/c9-1-2-14-8-7(13)6(12)5(11)4(3-10)15-8/h4-13H,1-3H2/t4-,5-,6+,7+,8+/m1/s1
Synonyms:	2-hydroxyethyl alpha-D-mannoside
Definition date:	2014-04-22
Last modified:	2020-07-17
Release date:	2015-04-22
Identifier:	2-hydroxyethyl alpha-D-mannopyranoside

2DG

2DG
Name:	2-deoxy-alpha-D-galactopyranose
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-lyxo-hexopyranose
Definition date:	2001-10-02
Last modified:	2020-07-17
Identifier:	2-deoxy-alpha-D-lyxo-hexopyranose

2DR

2DR
Name:	2-deoxy-beta-D-erythro-pentofuranose
Formula:	C5 H10 O4
SMILES:	OCC1OC(O)CC1O
InChi:	InChI=1S/C5H10O4/c6-2-4-3(7)1-5(8)9-4/h3-8H,1-2H2/t3-,4+,5+/m0/s1
Synonyms:	2-deoxy-beta-D-ribofuranose
Definition date:	2009-07-20
Last modified:	2020-07-17
Identifier:	2-deoxy-beta-D-erythro-pentofuranose

8OQ

8OQ
Name:	alpha-D-aceric acid
Formula:	C6 H10 O6
SMILES:	C[CH]1O[CH](O)[CH](O)[C]1(O)C(O)=O
InChi:	InChI=1S/C6H10O6/c1-2-6(11,5(9)10)3(7)4(8)12-2/h2-4,7-8,11H,1H3,(H,9,10)/t2-,3+,4+,6+/m1/s1
Definition date:	2017-02-14
Last modified:	2020-07-17
Release date:	2017-03-22
Identifier:	(2~{R},3~{R},4~{R},5~{S})-2-methyl-3,4,5-tris(oxidanyl)oxolane-3-carboxylic acid

8PK

8PK
Name:	4-O-[(1R)-1-hydroxyethyl]-2-O-methyl-alpha-L-fucopyranose
Formula:	C9 H18 O6
SMILES:	CO[CH]1[CH](O)O[CH](C)[CH](O[CH](C)O)[CH]1O
InChi:	InChI=1S/C9H18O6/c1-4-7(15-5(2)10)6(11)8(13-3)9(12)14-4/h4-12H,1-3H3/t4-,5+,6+,7+,8-,9+/m0/s1
Synonyms:	2-O-methyl, 4-O-Acetyl-alpha-L-fucosepyranose
Definition date:	2017-02-18
Last modified:	2020-07-17
Release date:	2017-03-22
Identifier:	(2~{R},3~{S},4~{R},5~{S},6~{S})-3-methoxy-6-methyl-5-[(1~{R})-1-oxidanylethoxy]oxane-2,4-diol

2F8

2F8
Name:	methyl 2-acetamido-2-deoxy-alpha-D-glucopyranoside
Formula:	C9 H17 N O6
SMILES:	O=C(NC1C(O)C(O)C(OC1OC)CO)C
InChi:	InChI=1S/C9H17NO6/c1-4(12)10-6-8(14)7(13)5(3-11)16-9(6)15-2/h5-9,11,13-14H,3H2,1-2H3,(H,10,12)/t5-,6-,7-,8-,9+/m1/s1
Synonyms:	methyl 2-(acetylamino)-2-deoxy-alpha-D-glucopyranoside
Definition date:	2013-10-08
Last modified:	2020-07-17
Release date:	2013-11-20
Identifier:	methyl 2-(acetylamino)-2-deoxy-alpha-D-glucopyranoside

2FG

2FG
Name:	2-deoxy-2-fluoro-beta-D-galactopyranose
Formula:	C6 H11 F O5
SMILES:	FC1C(O)C(O)C(OC1O)CO
InChi:	InChI=1S/C6H11FO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1H2/t2-,3-,4+,5-,6-/m1/s1
Synonyms:	2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSE
Definition date:	2001-10-02
Last modified:	2020-07-17
Identifier:	2-deoxy-2-fluoro-beta-D-galactopyranose

2FL

2FL
Name:	2-FLUORO-2-DEOXY-LACTOSE
Formula:	C12 H21 F O10
SMILES:	FC2C(O)C(O)C(OC2OC1C(OC(O)C(O)C1O)CO)CO
InChi:	InChI=1S/C12H21FO10/c13-5-7(17)6(16)3(1-14)22-12(5)23-10-4(2-15)21-11(20)9(19)8(10)18/h3-12,14-20H,1-2H2/t3-,4-,5-,6+,7-,8-,9-,10-,11-,12+/m1/s1
Synonyms:	2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSYL-BETA-D-GLUCOPYRANOSE
Definition date:	2001-09-27
Last modified:	2020-07-17
Identifier:	4-O-(2-deoxy-2-fluoro-beta-D-galactopyranosyl)-beta-D-glucopyranose

2GL

2GL
Name:	4-O-acetyl-2,6-dideoxy-beta-D-galactopyranose
Formula:	C8 H14 O5
SMILES:	O=C(OC1C(OC(O)CC1O)C)C
InChi:	InChI=1S/C8H14O5/c1-4-8(13-5(2)9)6(10)3-7(11)12-4/h4,6-8,10-11H,3H2,1-2H3/t4-,6-,7-,8+/m1/s1
Synonyms:	4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-GALACTO-HEXOPYRANOSE
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	4-O-acetyl-2,6-dideoxy-beta-D-lyxo-hexopyranose

2GS

2GS
Name:	2-O-methyl-alpha-D-galactopyranose
Formula:	C7 H14 O6
SMILES:	O(C)C1C(O)C(O)C(OC1O)CO
InChi:	InChI=1S/C7H14O6/c1-12-6-5(10)4(9)3(2-8)13-7(6)11/h3-11H,2H2,1H3/t3-,4+,5+,6-,7+/m1/s1
Synonyms:	2-O-methyl-alpha-D-galactose
Definition date:	2006-09-26
Last modified:	2020-07-17
Identifier:	2-O-methyl-alpha-D-galactopyranose

2H5

2H5
Name:	3-deoxy-3-fluoro-beta-D-galactopyranose
Formula:	C6 H11 F O5
SMILES:	FC1C(O)C(OC(O)C1O)CO
InChi:	InChI=1S/C6H11FO5/c7-3-4(9)2(1-8)12-6(11)5(3)10/h2-6,8-11H,1H2/t2-,3+,4+,5-,6-/m1/s1
Synonyms:	3-deoxy-3-fluoro-beta-D-galactose
Definition date:	2013-10-18
Last modified:	2020-07-17
Release date:	2014-02-05
Identifier:	3-deoxy-3-fluoro-beta-D-galactopyranose

K4W

K4W
Name:	4-[[[5-nitroso-2-[[(2~{R})-1-oxidanylbutan-2-yl]amino]-6-(propan-2-ylamino)pyrimidin-4-yl]amino]methyl]phenol
Formula:	C18 H26 N6 O3
SMILES:	CC[CH](CO)Nc1nc(NCc2ccc(O)cc2)c(N=O)c(NC(C)C)n1
InChi:	InChI=1S/C18H26N6O3/c1-4-13(10-25)21-18-22-16(15(24-27)17(23-18)20-11(2)3)19-9-12-5-7-14(26)8-6-12/h5-8,11,13,25-26H,4,9-10H2,1-3H3,(H3,19,20,21,22,23)/t13-/m1/s1
Definition date:	2019-04-24
Last modified:	2020-07-17
Release date:	2020-07-22
Identifier:	4-[[[5-nitroso-2-[[(2~{R})-1-oxidanylbutan-2-yl]amino]-6-(propan-2-ylamino)pyrimidin-4-yl]amino]methyl]phenol

K5B

K5B
Name:	4,7-anhydro-3-deoxy-D-gluco-oct-2-ulosonic acid
Formula:	C8 H12 O7
SMILES:	OC[CH]1O[CH](CC(=O)C(O)=O)[CH](O)[CH]1O
InChi:	InChI=1S/C8H12O7/c9-2-5-7(12)6(11)4(15-5)1-3(10)8(13)14/h4-7,9,11-12H,1-2H2,(H,13,14)/t4-,5+,6+,7+/m0/s1
Synonyms:	4,7-anhydro-3-deoxy-D-manno-oct-2-ulosonic acid
Definition date:	2017-09-07
Last modified:	2020-07-17
Release date:	2018-06-20
Identifier:	3-[(2~{S},3~{S},4~{S},5~{R})-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-2-oxidanylidene-propanoic acid

2M4

2M4
Name:	2-O-alpha-D-mannopyranosyl-alpha-D-mannopyranose
Formula:	C12 H22 O11
SMILES:	O(C1C(O)OC(CO)C(O)C1O)C2OC(C(O)C(O)C2O)CO
InChi:	InChI=1S/C12H22O11/c13-1-3-6(16)8(18)10(11(20)21-3)23-12-9(19)7(17)5(15)4(2-14)22-12/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8+,9+,10+,11+,12-/m1/s1
Definition date:	2010-08-16
Last modified:	2020-07-17
Identifier:	2-O-alpha-D-mannopyranosyl-alpha-D-mannopyranose

2M5

2M5
Name:	methyl 7-deoxy-L-glycero-alpha-D-manno-heptopyranoside
Formula:	C8 H16 O6
SMILES:	OC1C(O)C(O)C(OC1OC)C(O)C
InChi:	InChI=1S/C8H16O6/c1-3(9)7-5(11)4(10)6(12)8(13-2)14-7/h3-12H,1-2H3/t3-,4-,5-,6-,7+,8-/m0/s1
Synonyms:	methyl 7-deoxy-L-glycero-alpha-D-manno-heptoside
Definition date:	2010-08-16
Last modified:	2020-07-17
Identifier:	methyl 7-deoxy-L-glycero-alpha-D-manno-heptopyranoside

2M8

2M8
Name:	(2R)-3-hydroxy-2-(alpha-D-mannopyranosyloxy)propanoic acid
Formula:	C9 H16 O9
SMILES:	O=C(O)C(OC1OC(C(O)C(O)C1O)CO)CO
InChi:	InChI=1S/C9H16O9/c10-1-3-5(12)6(13)7(14)9(17-3)18-4(2-11)8(15)16/h3-7,9-14H,1-2H2,(H,15,16)/t3-,4-,5-,6+,7+,9-/m1/s1
Synonyms:	2-O-ALPHA-MANNOSYL-D-GLYCERATE
Definition date:	2011-07-14
Last modified:	2020-07-17
Identifier:	(2R)-3-hydroxy-2-(alpha-D-mannopyranosyloxy)propanoic acid

K8Q

K8Q
Name:	4-(4-bromanyl-2-oxidanylidene-3~{H}-benzimidazol-1-yl)-~{N}-(4-iodophenyl)piperidine-1-carboxamide
Formula:	C19 H18 Br I N4 O2
SMILES:	Brc1cccc2N(C3CCN(CC3)C(=O)Nc4ccc(I)cc4)C(=O)Nc12
InChi:	InChI=1S/C19H18BrIN4O2/c20-15-2-1-3-16-17(15)23-19(27)25(16)14-8-10-24(11-9-14)18(26)22-13-6-4-12(21)5-7-13/h1-7,14H,8-11H2,(H,22,26)(H,23,27)
Definition date:	2019-05-03
Last modified:	2020-07-17
Release date:	2020-07-22
Identifier:	4-(4-bromanyl-2-oxidanylidene-3~{H}-benzimidazol-1-yl)-~{N}-(4-iodophenyl)piperidine-1-carboxamide

K99

K99
Name:	(2R,3R,4R,5R,6S)-2,3-bis(fluoranyl)-4,5-bis(oxidanyl)-6-[(1R,2R)-1,2,3-tris(oxidanyl)propyl]oxane-2-carboxylic acid
Formula:	C9 H14 F2 O8
SMILES:	OC[CH](O)[CH](O)[CH]1O[C](F)([CH](F)[CH](O)[CH]1O)C(O)=O
InChi:	InChI=1S/C9H14F2O8/c10-7-5(16)4(15)6(3(14)2(13)1-12)19-9(7,11)8(17)18/h2-7,12-16H,1H2,(H,17,18)/t2-,3-,4-,5-,6+,7-,9-/m1/s1
Synonyms:	(2R,3R,4R,5R,6S)-2,3-DIFLUORO-4,5-DIHYDROXY-6-[(1R,2R)-1,2,3-TRIHYDROXYPROPYL]OXANE-2-CARBOXYLIC ACID
Definition date:	2010-11-26
Last modified:	2020-07-17
Identifier:	(2R,3R,4R,5R,6S)-2,3-difluoro-4,5-dihydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid

2OS

2OS
Name:	3-N-OCTANOYLSUCROSE
Formula:	C20 H36 O12
SMILES:	O=C(OC1C(O)C(OC(CO)C1O)OC2(OC(C(O)C2O)CO)CO)CCCCCCC
InChi:	InChI=1S/C20H36O12/c1-2-3-4-5-6-7-13(24)30-17-14(25)11(8-21)29-19(16(17)27)32-20(10-23)18(28)15(26)12(9-22)31-20/h11-12,14-19,21-23,25-28H,2-10H2,1H3/t11-,12-,14-,15-,16-,17+,18+,19-,20+/m1/s1
Synonyms:	3'-O-N-OCTANOYL-A-D-GLUCOPYRANOSYL-B-D-FRUCTOFURANOSIDE
Definition date:	2004-05-02
Last modified:	2020-07-17
Identifier:	beta-D-fructofuranosyl 3-O-octanoyl-alpha-D-glucopyranoside

KBA

KBA
Name:	2-(1H-1,2,3-triazol-1-yl)ethyl 6-deoxy-alpha-L-galactopyranoside
Formula:	C10 H17 N3 O5
SMILES:	C[CH]1O[CH](OCCn2ccnn2)[CH](O)[CH](O)[CH]1O
InChi:	InChI=1S/C10H17N3O5/c1-6-7(14)8(15)9(16)10(18-6)17-5-4-13-3-2-11-12-13/h2-3,6-10,14-16H,4-5H2,1H3/t6-,7+,8+,9-,10+/m0/s1
Synonyms:	(2~{S},3~{S},4~{R},5~{S},6~{R})-2-methyl-6-[2-(1,2,3-triazol-1-yl)ethoxy]oxane-3,4,5-triol
Definition date:	2018-06-28
Last modified:	2020-07-17
Release date:	2018-08-22
Identifier:	(2~{S},3~{S},4~{R},5~{S},6~{R})-2-methyl-6-[2-(1,2,3-triazol-1-yl)ethoxy]oxane-3,4,5-triol

KBG

KBG
Name:	beta-D-arabino-hexopyranos-2-ulose
Formula:	C6 H10 O6
SMILES:	O=C1C(O)OC(CO)C(O)C1O
InChi:	InChI=1S/C6H10O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-4,6-9,11H,1H2/t2-,3-,4+,6-/m1/s1
Synonyms:	2-KETO-BETA-D-GLUCOSE
Definition date:	2006-01-09
Last modified:	2020-07-17
Identifier:	beta-D-arabino-hexopyranos-2-ulose

KD5

KD5
Name:	4,7-anhydro-3-deoxy-D-manno-oct-2-ulosonic acid
Formula:	C8 H12 O7
SMILES:	O=C(O)C(=O)CC1OC(CO)C(O)C1O
InChi:	InChI=1S/C8H12O7/c9-2-5-7(12)6(11)4(15-5)1-3(10)8(13)14/h4-7,9,11-12H,1-2H2,(H,13,14)/t4?,5-,6-,7-/m1/s1
Definition date:	2012-03-22
Last modified:	2020-07-17
Release date:	2013-03-27
Identifier:	4,7-anhydro-3-deoxy-D-manno-oct-2-ulosonic acid

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