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PDB Info pages Status search Chemie search: 908 results BIRD

9T7

9T7
Name:	(2R,3R,4R,5R,6R)-5-acetamido-6-[(1R,2R)-1,2-bis(oxidanyl)propyl]-2,3-bis(fluoranyl)-4-oxidanyl-oxane-2-carboxylic acid
Formula:	C11 H17 F2 N O7
SMILES:	OC(C1(OC(C(C(C)O)O)C(C(C1F)O)NC(=O)C)F)=O
InChi:	InChI=1S/C11H17F2NO7/c1-3(15)6(17)8-5(14-4(2)16)7(18)9(12)11(13,21-8)10(19)20/h3,5-9,15,17-18H,1-2H3,(H,14,16)(H,19,20)/t3-,5-,6-,7-,8-,9-,11-/m1/s1
Synonyms:	(2~{R},3~{R},4~{R},5~{R},6~{R})-5-acetamido-6-[(1~{R},2~{R})-1,2-bis(oxidanyl)propyl]-2,3-bis(fluoranyl)-4-oxidanyl-oxa ne-2-carboxylic acid
Definition date:	2017-06-07
Last modified:	2020-07-17
Release date:	2018-02-21
Identifier:	(2R,3R,4R,5R,6R)-5-(acetylamino)-6-[(1R,2R)-1,2-dihydroxypropyl]-2,3-difluoro-4-hydroxytetrahydro-2H-pyran-2-carboxylic acid (non-preferred name)

0WK

0WK
Name:	1,5-anhydro-6-O-phosphono-D-glucitol
Formula:	C6 H13 O8 P
SMILES:	O=P(O)(O)OCC1OCC(O)C(O)C1O
InChi:	InChI=1S/C6H13O8P/c7-3-1-13-4(6(9)5(3)8)2-14-15(10,11)12/h3-9H,1-2H2,(H2,10,11,12)/t3-,4+,5+,6+/m0/s1
Definition date:	2012-07-24
Last modified:	2020-07-17
Release date:	2013-07-03
Identifier:	1,5-anhydro-6-O-phosphono-D-glucitol

NA1

NA1
Name:	2-acetamido-2-deoxy-6-O-methyl-alpha-D-allopyranose
Formula:	C9 H17 N O6
SMILES:	O=C(NC1C(O)C(O)C(OC1O)COC)C
InChi:	InChI=1S/C9H17NO6/c1-4(11)10-6-8(13)7(12)5(3-15-2)16-9(6)14/h5-9,12-14H,3H2,1-2H3,(H,10,11)/t5-,6-,7-,8+,9?/m1/s1
Synonyms:	METHYL N-ACETYL ALLOSAMINE
Definition date:	2003-03-10
Last modified:	2020-07-17
Identifier:	2-(acetylamino)-2-deoxy-6-O-methyl-alpha-D-allopyranose

NAA

NAA
Name:	2-acetamido-2-deoxy-beta-D-allopyranose
Formula:	C8 H15 N O6
SMILES:	O=C(NC1C(O)C(O)C(OC1O)CO)C
InChi:	InChI=1S/C8H15NO6/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
Synonyms:	N-acetyl-beta-D-allosamine
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	2-(acetylamino)-2-deoxy-beta-D-allopyranose

12E

12E
Name:	N-{[(2E)-2-(pyridin-4-ylmethylidene)hydrazino]carbonothioyl}-beta-D-glucopyranosylamine
Formula:	C13 H18 N4 O5 S
SMILES:	S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2ccncc2
InChi:	InChI=1S/C13H18N4O5S/c18-6-8-9(19)10(20)11(21)12(22-8)16-13(23)17-15-5-7-1-3-14-4-2-7/h1-5,8-12,18-21H,6H2,(H2,16,17,23)/b15-5+/t8-,9-,10+,11-,12-/m1/s1
Synonyms:	4-pyridinecarboxaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone
Definition date:	2010-04-30
Last modified:	2020-07-17
Identifier:	N-{[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine

NBX

NBX
Name:	N-{[(4-aminophenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine
Formula:	C14 H19 N3 O7
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)NC(=O)c2ccc(N)cc2
InChi:	InChI=1S/C14H19N3O7/c15-7-3-1-6(2-4-7)12(22)16-14(23)17-13-11(21)10(20)9(19)8(5-18)24-13/h1-4,8-11,13,18-21H,5,15H2,(H2,16,17,22,23)/t8-,9-,10+,11-,13-/m1/s1
Synonyms:	N-{[(4-aminophenyl)carbonyl]carbamoyl}-beta-D-glucosylamine
Definition date:	2008-02-13
Last modified:	2020-07-17
Identifier:	N-{[(4-aminophenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine

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

145

145
Name:	2-nitrophenyl beta-D-galactopyranoside
Formula:	C12 H15 N O8
SMILES:	[O-][N+](=O)c2c(OC1OC(C(O)C(O)C1O)CO)cccc2
InChi:	InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-4-2-1-3-6(7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9+,10+,11-,12-/m1/s1
Synonyms:	1-O-[O-NITROPHENYL]-BETA-D-GALACTOPYRANOSE
Definition date:	2001-09-26
Last modified:	2020-07-17
Identifier:	2-nitrophenyl beta-D-galactopyranoside

147

147
Name:	4-nitrophenyl beta-D-galactopyranoside
Formula:	C12 H15 N O8
SMILES:	[O-][N+](=O)c2ccc(OC1OC(C(O)C(O)C1O)CO)cc2
InChi:	InChI=1S/C12H15NO8/c14-5-8-9(15)10(16)11(17)12(21-8)20-7-3-1-6(2-4-7)13(18)19/h1-4,8-12,14-17H,5H2/t8-,9+,10+,11-,12-/m1/s1
Synonyms:	1-O-[P-NITROPHENYL]-BETA-D-GALACTOPYRANOSE
Definition date:	2001-09-27
Last modified:	2020-07-17
Identifier:	4-nitrophenyl beta-D-galactopyranoside

149

149
Name:	D-galactonolactone
Formula:	C6 H10 O6
SMILES:	O=C1OC(CO)C(O)C(O)C1O
InChi:	InChI=1S/C6H10O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-5,7-10H,1H2/t2-,3+,4+,5-/m1/s1
Synonyms:	(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-one
Definition date:	2001-10-02
Last modified:	2020-07-17
Identifier:	(3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-one (non-preferred name)

14T

14T
Name:	3,4-difluorophenyl 2-deoxy-2-[(difluoroacetyl)amino]-beta-D-glucopyranoside
Formula:	C14 H15 F4 N O6
SMILES:	FC(F)C(=O)NC2C(O)C(O)C(OC2Oc1cc(F)c(F)cc1)CO
InChi:	InChI=1S/C14H15F4NO6/c15-6-2-1-5(3-7(6)16)24-14-9(19-13(23)12(17)18)11(22)10(21)8(4-20)25-14/h1-3,8-12,14,20-22H,4H2,(H,19,23)/t8-,9-,10-,11-,14-/m1/s1
Synonyms:	3,4-difluorophenyl 2-deoxy-2-[(difluoroacetyl)amino]-beta-D-glucoside
Definition date:	2009-12-08
Last modified:	2020-07-17
Identifier:	3,4-difluorophenyl 2-deoxy-2-[(difluoroacetyl)amino]-beta-D-glucopyranoside

15L

15L
Name:	D-galactaro-1,5-lactone
Formula:	C6 H8 O7
SMILES:	O=C(O)C1OC(=O)C(O)C(O)C1O
InChi:	InChI=1S/C6H8O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,7-9H,(H,10,11)/t1-,2+,3+,4-/m0/s1
Synonyms:	galactaro-1,5-lactone
Definition date:	2011-04-11
Last modified:	2020-07-17
Identifier:	(2S,3R,4S,5R)-3,4,5-trihydroxy-6-oxotetrahydro-2H-pyran-2-carboxylic acid (non-preferred name)

NFG

NFG
Name:	2,4-dinitrophenyl 2-deoxy-2-fluoro-beta-D-glucopyranoside
Formula:	C12 H13 F N2 O9
SMILES:	[O-][N+](=O)c2ccc(OC1OC(C(O)C(O)C1F)CO)c([N+]([O-])=O)c2
InChi:	InChI=1S/C12H13FN2O9/c13-9-11(18)10(17)8(4-16)24-12(9)23-7-2-1-5(14(19)20)3-6(7)15(21)22/h1-3,8-12,16-18H,4H2/t8-,9-,10-,11-,12-/m1/s1
Synonyms:	2,4-dinitrophenyl 2-deoxy-2-fluoro-beta-D-glucoside
Definition date:	2000-07-07
Last modified:	2020-07-17
Identifier:	2,4-dinitrophenyl 2-deoxy-2-fluoro-beta-D-glucopyranoside

16F

16F
Name:	N-({(2Z)-2-[(3-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=Cc2cccc(O)c2
InChi:	InChI=1S/C14H19N3O6S/c18-6-9-10(20)11(21)12(22)13(23-9)16-14(24)17-15-5-7-2-1-3-8(19)4-7/h1-5,9-13,18-22H,6H2,(H2,16,17,24)/b15-5-/t9-,10-,11+,12-,13-/m1/s1
Synonyms:	3-hydroxybenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone
Definition date:	2010-04-30
Last modified:	2020-07-17
Identifier:	N-{[(2Z)-2-(3-hydroxybenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine

16G

16G
Name:	2-acetamido-2-deoxy-6-O-phosphono-alpha-D-glucopyranose
Formula:	C8 H16 N O9 P
SMILES:	O=P(O)(O)OCC1OC(O)C(NC(=O)C)C(O)C1O
InChi:	InChI=1S/C8H16NO9P/c1-3(10)9-5-7(12)6(11)4(18-8(5)13)2-17-19(14,15)16/h4-8,11-13H,2H2,1H3,(H,9,10)(H2,14,15,16)/t4-,5-,6-,7-,8+/m1/s1
Synonyms:	N-ACETYL-D-GLUCOSAMINE-6-PHOSPHATE
Definition date:	2000-09-13
Last modified:	2020-07-17
Identifier:	2-(acetylamino)-2-deoxy-6-O-phosphono-alpha-D-glucopyranose

16O

16O
Name:	N-({(2E)-2-[(4-bromophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucopyranosylamine
Formula:	C14 H18 Br N3 O5 S
SMILES:	S=C(NC1OC(C(O)C(O)C1O)CO)N/N=C/c2ccc(Br)cc2
InChi:	InChI=1S/C14H18BrN3O5S/c15-8-3-1-7(2-4-8)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:	4-bromobenzaldehyde-4-(beta-D-glucopyranosyl) thiosemicarbazone
Definition date:	2010-05-03
Last modified:	2020-07-17
Identifier:	N-{[(2E)-2-(4-bromobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine

NG1

NG1
Name:	2-acetamido-2-deoxy-1-O-phosphono-alpha-D-galactopyranose
Formula:	C8 H16 N O9 P
SMILES:	O=P(OC1OC(C(O)C(O)C1NC(=O)C)CO)(O)O
InChi:	InChI=1S/C8H16NO9P/c1-3(11)9-5-7(13)6(12)4(2-10)17-8(5)18-19(14,15)16/h4-8,10,12-13H,2H2,1H3,(H,9,11)(H2,14,15,16)/t4-,5-,6+,7-,8-/m1/s1
Synonyms:	N-ACETYL-ALPHA-D-GALACTOSAMINE 1-PHOSPHATE
Definition date:	2005-06-27
Last modified:	2020-07-17
Identifier:	2-(acetylamino)-2-deoxy-1-O-phosphono-alpha-D-galactopyranose

NG6

NG6
Name:	2-acetamido-2-deoxy-6-O-sulfo-beta-D-galactopyranose
Formula:	C8 H15 N O9 S
SMILES:	O=S(=O)(O)OCC1OC(O)C(NC(=O)C)C(O)C1O
InChi:	InChI=1S/C8H15NO9S/c1-3(10)9-5-7(12)6(11)4(18-8(5)13)2-17-19(14,15)16/h4-8,11-13H,2H2,1H3,(H,9,10)(H,14,15,16)/t4-,5-,6+,7-,8-/m1/s1
Synonyms:	N-ACETYL-D-GALACTOSAMINE 6-SULFATE
Definition date:	2000-12-12
Last modified:	2020-07-17
Identifier:	2-(acetylamino)-2-deoxy-6-O-sulfo-beta-D-galactopyranose

NGC

NGC
Name:	N-glycolyl-alpha-neuraminic acid
Formula:	C11 H19 N O10
SMILES:	O=C(O)C1(O)OC(C(NC(=O)CO)C(O)C1)C(O)C(O)CO
InChi:	InChI=1S/C11H19NO10/c13-2-5(16)8(18)9-7(12-6(17)3-14)4(15)1-11(21,22-9)10(19)20/h4-5,7-9,13-16,18,21H,1-3H2,(H,12,17)(H,19,20)/t4-,5+,7+,8+,9+,11+/m0/s1
Synonyms:	N-glycolylneuraminic acid
Definition date:	2008-07-25
Last modified:	2020-07-17
Identifier:	3,5-dideoxy-5-[(hydroxyacetyl)amino]-D-glycero-alpha-D-galacto-non-2-ulopyranosonic acid

NGE

NGE
Name:	N-glycolyl-beta-neuraminic acid
Formula:	C11 H19 N O10
SMILES:	O=C(O)C1(O)OC(C(O)C(O)CO)C(NC(=O)CO)C(O)C1
InChi:	InChI=1S/C11H19NO10/c13-2-5(16)8(18)9-7(12-6(17)3-14)4(15)1-11(21,22-9)10(19)20/h4-5,7-9,13-16,18,21H,1-3H2,(H,12,17)(H,19,20)/t4-,5+,7+,8+,9+,11-/m0/s1
Synonyms:	N-glycolylneuraminic acid
Definition date:	2009-11-05
Last modified:	2020-07-17
Identifier:	3,5-dideoxy-5-[(hydroxyacetyl)amino]-D-glycero-beta-D-galacto-non-2-ulopyranosonic acid

NGK

NGK
Name:	2-acetamido-2-deoxy-4-O-sulfo-alpha-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-(ACETYLAMINO)-2-DEOXY-4-O-SULFO-ALPHA-D-GALACTOPYRANOSE
Definition date:	2003-04-15
Last modified:	2020-07-17
Identifier:	2-(acetylamino)-2-deoxy-4-O-sulfo-alpha-D-galactopyranose

NGS

NGS
Name:	2-acetamido-2-deoxy-6-O-sulfo-beta-D-glucopyranose
Formula:	C8 H15 N O9 S
SMILES:	O=S(=O)(O)OCC1OC(O)C(NC(=O)C)C(O)C1O
InChi:	InChI=1S/C8H15NO9S/c1-3(10)9-5-7(12)6(11)4(18-8(5)13)2-17-19(14,15)16/h4-8,11-13H,2H2,1H3,(H,9,10)(H,14,15,16)/t4-,5-,6-,7-,8-/m1/s1
Synonyms:	2-(acetylamino)-2-deoxy-6-O-sulfo-beta-D-glucopyranose
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	2-(acetylamino)-2-deoxy-6-O-sulfo-beta-D-glucopyranose

NGY

NGY
Name:	2-acetamido-2-deoxy-6-O-sulfo-alpha-D-glucopyranose
Formula:	C8 H15 N O9 S
SMILES:	O=S(=O)(O)OCC1OC(O)C(NC(=O)C)C(O)C1O
InChi:	InChI=1S/C8H15NO9S/c1-3(10)9-5-7(12)6(11)4(18-8(5)13)2-17-19(14,15)16/h4-8,11-13H,2H2,1H3,(H,9,10)(H,14,15,16)/t4-,5-,6-,7-,8+/m1/s1
Synonyms:	2-(acetylamino)-2-deoxy-6-O-sulfo-alpha-D-glucopyranose
Definition date:	2008-06-13
Last modified:	2020-07-17
Identifier:	2-(acetylamino)-2-deoxy-6-O-sulfo-alpha-D-glucopyranose

NGZ

NGZ
Name:	2-acetamido-2-deoxy-alpha-L-glucopyranose
Formula:	C8 H15 N O6
SMILES:	C1(C(C(C(C(CO)O1)O)O)NC(C)=O)O
InChi:	InChI=1S/C8H15NO6/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+/m0/s1
Synonyms:	N-acetyl-alpha-L-glucosamine
Definition date:	2004-06-10
Last modified:	2020-07-17
Identifier:	2-(acetylamino)-2-deoxy-alpha-L-glucopyranose

17T

17T
Name:	N-({(2E)-2-[(4-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/c2ccc(Cl)cc2
InChi:	InChI=1S/C14H18ClN3O5S/c15-8-3-1-7(2-4-8)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:	N-({(2E)-2-[(4-chlorophenyl)methylidene]hydrazino}carbonothioyl)-beta-D-glucosylamine
Definition date:	2010-05-03
Last modified:	2020-07-17
Identifier:	N-{[(2E)-2-(4-chlorobenzylidene)hydrazinyl]carbothioyl}-beta-D-glucopyranosylamine

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