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PDB Info pages Status search Chemie search: 902 results BIRD

PUF

PUF
Name:	6-deoxy-alpha-L-psicofuranose
Formula:	C6 H12 O5
SMILES:	C(O)C1(C(C(O)C(O1)C)O)O
InChi:	InChI=1S/C6H12O5/c1-3-4(8)5(9)6(10,2-7)11-3/h3-5,7-10H,2H2,1H3/t3-,4-,5-,6+/m0/s1
Synonyms:	6-deoxy-alpha-L-psicose
Definition date:	2015-03-30
Last modified:	2020-07-17
Release date:	2016-03-23
Identifier:	6-deoxy-alpha-L-psicofuranose

6GP

6GP
Name:	N-[methoxy(oxo)acetyl]-beta-D-glucopyranosylamine
Formula:	C9 H15 N O8
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)C(=O)OC
InChi:	InChI=1S/C9H15NO8/c1-17-9(16)7(15)10-8-6(14)5(13)4(12)3(2-11)18-8/h3-6,8,11-14H,2H2,1H3,(H,10,15)/t3-,4-,5+,6-,8-/m1/s1
Synonyms:	METHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATE
Definition date:	2006-01-25
Last modified:	2020-07-17
Identifier:	N-[methoxy(oxo)acetyl]-beta-D-glucopyranosylamine

6GR

6GR
Name:	2-(alpha-L-altropyranosyloxy)benzoic acid
Formula:	C13 H16 O8
SMILES:	C2(O)C(O)C(Oc1c(C(=O)O)cccc1)OC(C2O)CO
InChi:	InChI=1S/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-4-2-1-3-6(7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/t8-,9-,10-,11+,13+/m0/s1
Synonyms:	2-(alpha-L-altrosyloxy)benzoic acid
Definition date:	2016-04-07
Last modified:	2020-07-17
Release date:	2019-10-09
Identifier:	2-(alpha-L-altropyranosyloxy)benzoic acid

PZU

PZU
Name:	alpha-D-Paratopyranose
Formula:	C6 H12 O4
SMILES:	OC1C(OC(O)C(O)C1)C
InChi:	InChI=1S/C6H12O4/c1-3-4(7)2-5(8)6(9)10-3/h3-9H,2H2,1H3/t3-,4+,5-,6+/m1/s1
Synonyms:	alpha-D-Paratose
Definition date:	2011-09-02
Last modified:	2020-07-17
Release date:	2012-08-24
Identifier:	3,6-dideoxy-alpha-D-ribo-hexopyranose

6K3

6K3
Name:	heptyl 4-deoxy-4-fluoro-alpha-D-mannopyranoside
Formula:	C13 H25 F O5
SMILES:	CCCCCCCO[CH]1O[CH](CO)[CH](F)[CH](O)[CH]1O
InChi:	InChI=1S/C13H25FO5/c1-2-3-4-5-6-7-18-13-12(17)11(16)10(14)9(8-15)19-13/h9-13,15-17H,2-8H2,1H3/t9-,10-,11+,12+,13+/m1/s1
Synonyms:	4-Fluoro-Heptylmannoside
Definition date:	2016-05-27
Last modified:	2020-07-17
Release date:	2017-06-21
Identifier:	(2~{S},3~{S},4~{R},5~{S},6~{R})-5-fluoranyl-2-heptoxy-6-(hydroxymethyl)oxane-3,4-diol

6KH

6KH
Name:	heptyl 3-fluoro-alpha-D-mannopyranoside
Formula:	C13 H25 F O5
SMILES:	CCCCCCCO[CH]1O[CH](CO)[CH](O)[CH](F)[CH]1O
InChi:	InChI=1S/C13H25FO5/c1-2-3-4-5-6-7-18-13-12(17)10(14)11(16)9(8-15)19-13/h9-13,15-17H,2-8H2,1H3/t9-,10+,11-,12+,13+/m1/s1
Synonyms:	3-Fluoro-Heptylmannoside
Definition date:	2016-05-27
Last modified:	2020-07-17
Release date:	2017-06-21
Identifier:	(2~{S},3~{R},4~{S},5~{R},6~{R})-4-fluoranyl-2-heptoxy-6-(hydroxymethyl)oxane-3,5-diol

6KL

6KL
Name:	methyl 4,5-bisacetamido-3,4,5-trideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
Formula:	C14 H24 N2 O9
SMILES:	C(O)(C1(OC)OC(C(C(C1)NC(C)=O)NC(C)=O)C(C(CO)O)O)=O
InChi:	InChI=1S/C14H24N2O9/c1-6(18)15-8-4-14(24-3,13(22)23)25-12(10(8)16-7(2)19)11(21)9(20)5-17/h8-12,17,20-21H,4-5H2,1-3H3,(H,15,18)(H,16,19)(H,22,23)/t8-,9+,10+,11+,12+,14+/m0/s1
Synonyms:	methyl 4,5-bis(acetylamino)-3,4,5-trideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid
Definition date:	2016-04-22
Last modified:	2020-07-17
Release date:	2016-05-11
Identifier:	methyl 4,5-bis(acetylamino)-3,4,5-trideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranosidonic acid

6KS

6KS
Name:	heptyl 2-fluoro-alpha-D-mannopyranoside
Formula:	C13 H25 F O5
SMILES:	CCCCCCCO[CH]1O[CH](CO)[CH](O)[CH](O)[CH]1F
InChi:	InChI=1S/C13H25FO5/c1-2-3-4-5-6-7-18-13-10(14)12(17)11(16)9(8-15)19-13/h9-13,15-17H,2-8H2,1H3/t9-,10+,11-,12-,13+/m1/s1
Synonyms:	2-Fluoro-Heptylmannoside
Definition date:	2016-05-27
Last modified:	2020-07-17
Release date:	2017-06-21
Identifier:	(2~{R},3~{S},4~{S},5~{S},6~{S})-5-fluoranyl-6-heptoxy-2-(hydroxymethyl)oxane-3,4-diol

6KU

6KU
Name:	heptyl 4-deoxy-4-deoxy-alpha-D-mannopyranoside
Formula:	C13 H26 O5
SMILES:	CCCCCCCO[CH]1O[CH](CO)C[CH](O)[CH]1O
InChi:	InChI=1S/C13H26O5/c1-2-3-4-5-6-7-17-13-12(16)11(15)8-10(9-14)18-13/h10-16H,2-9H2,1H3/t10-,11-,12-,13-/m0/s1
Synonyms:	4-Deoxy-Heptylmannoside
Definition date:	2016-05-27
Last modified:	2020-07-17
Release date:	2017-06-21
Identifier:	(2~{S},3~{S},4~{S},6~{S})-2-heptoxy-6-(hydroxymethyl)oxane-3,4-diol

6KW

6KW
Name:	heptyl 3-deoxy-alpha-D-mannopyranoside
Formula:	C13 H26 O5
SMILES:	CCCCCCCO[CH]1O[CH](CO)[CH](O)C[CH]1O
InChi:	InChI=1S/C13H26O5/c1-2-3-4-5-6-7-17-13-11(16)8-10(15)12(9-14)18-13/h10-16H,2-9H2,1H3/t10-,11-,12+,13-/m0/s1
Synonyms:	3-Deoxy-Heptylmannoside
Definition date:	2016-05-27
Last modified:	2020-07-17
Release date:	2017-06-21
Identifier:	(2~{S},3~{S},5~{S},6~{R})-2-heptoxy-6-(hydroxymethyl)oxane-3,5-diol

95Z

95Z
Name:	2-amino-2-deoxy-alpha-D-mannopyranose
Formula:	C6 H13 N O5
SMILES:	N[CH]1[CH](O)O[CH](CO)[CH](O)[CH]1O
InChi:	InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3+,4-,5-,6+/m1/s1
Synonyms:	alpha-D-mannosamine
Definition date:	2017-04-25
Last modified:	2020-07-17
Release date:	2017-12-27
Identifier:	(2~{S},3~{S},4~{R},5~{S},6~{R})-3-azanyl-6-(hydroxymethyl)oxane-2,4,5-triol

96O

96O
Name:	(1-methyl-1H-1,2,3-triazol-4-yl)methyl alpha-D-mannopyranoside
Formula:	C10 H17 N3 O6
SMILES:	C2(C(C(C(OCc1nnn(C)c1)OC2CO)O)O)O
InChi:	InChI=1S/C10H17N3O6/c1-13-2-5(11-12-13)4-18-10-9(17)8(16)7(15)6(3-14)19-10/h2,6-10,14-17H,3-4H2,1H3/t6-,7-,8+,9+,10+/m1/s1
Synonyms:	(1-methyl-1H-1,2,3-triazol-4-yl)methyl alpha-D-mannoside
Definition date:	2018-01-25
Last modified:	2020-07-17
Release date:	2019-04-10
Identifier:	(1-methyl-1H-1,2,3-triazol-4-yl)methyl alpha-D-mannopyranoside

9AM

9AM
Name:	9-AMINO-2-DEOXY-2,3-DEHYDRO-N-ACETYL-NEURAMINIC ACID
Formula:	C11 H18 N2 O7
SMILES:	O=C(O)C=1OC(C(O)C(O)CN)C(NC(=O)C)C(O)C=1
InChi:	InChI=1S/C11H18N2O7/c1-4(14)13-8-5(15)2-7(11(18)19)20-10(8)9(17)6(16)3-12/h2,5-6,8-10,15-17H,3,12H2,1H3,(H,13,14)(H,18,19)/t5-,6+,8+,9+,10+/m0/s1
Definition date:	2000-07-21
Last modified:	2020-07-17
Identifier:	5-(acetylamino)-9-amino-2,6-anhydro-3,5,9-trideoxy-D-glycero-D-galacto-non-2-enonic acid

B0D

B0D
Name:	(2R,3S,4R,5R,6R)-2,6-difluoro-2-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol
Formula:	C6 H10 F2 O5
SMILES:	FC1OC(F)(C(O)C(O)C1O)CO
InChi:	InChI=1S/C6H10F2O5/c7-5-3(11)2(10)4(12)6(8,1-9)13-5/h2-5,9-12H,1H2/t2-,3-,4+,5+,6+/m1/s1
Definition date:	2009-08-18
Last modified:	2020-07-17
Identifier:	(2R,3S,4R,5R,6R)-2,6-difluoro-2-(hydroxymethyl)tetrahydro-2H-pyran-3,4,5-triol (non-preferred name)

QIF

QIF
Name:	1-deoxy-7-O-phosphono-alpha-D-gluco-hept-2-ulopyranose
Formula:	C7 H15 O9 P
SMILES:	C1(C(C(O)C(C(COP(=O)(O)O)O1)O)O)(O)C
InChi:	InChI=1S/C7H15O9P/c1-7(11)6(10)5(9)4(8)3(16-7)2-15-17(12,13)14/h3-6,8-11H,2H2,1H3,(H2,12,13,14)/t3-,4-,5+,6-,7+/m1/s1
Synonyms:	1-deoxy-7-O-phosphono-alpha-D-gluco-hept-2-ulose
Definition date:	2018-11-09
Last modified:	2020-07-17
Release date:	2019-05-01
Identifier:	1-deoxy-7-O-phosphono-alpha-D-gluco-hept-2-ulopyranose

B16

B16
Name:	1,6-di-O-phosphono-beta-D-glucopyranose
Formula:	C6 H14 O12 P2
SMILES:	O=P(O)(O)OCC1OC(OP(=O)(O)O)C(O)C(O)C1O
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)/t2-,3-,4+,5-,6+/m1/s1
Synonyms:	1,6-di-O-phosphono-beta-D-glucose
Definition date:	2011-12-06
Last modified:	2020-07-17
Identifier:	1,6-di-O-phosphono-beta-D-glucopyranose

B1H

B1H
Name:	(1S)-1,5-anhydro-1-(3-{4-[hydroxy(oxo)azaniumyl]phenyl}-1H-1,2,4-triazol-5-yl)-D-glucitol
Formula:	C14 H17 N4 O7
SMILES:	OC[CH]1O[CH]([CH](O)[CH](O)[CH]1O)c2[nH]nc(n2)c3ccc(cc3)[N+](O)=O
InChi:	InChI=1S/C14H17N4O7/c19-5-8-9(20)10(21)11(22)12(25-8)14-15-13(16-17-14)6-1-3-7(4-2-6)18(23)24/h1-4,8-12,19-22H,5H2,(H,23,24)(H,15,16,17)/q+1/t8-,9-,10+,11-,12-/m1/s1
Synonyms:	[4-[5-[(2~{S},3~{R},4~{R},5~{S},6~{R})-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-1~{H}-1,2,4-triazol-3-yl]phenyl ]-oxidanyl-oxidanylidene-azanium
Definition date:	2017-09-05
Last modified:	2020-07-17
Release date:	2018-02-28
Identifier:	[4-[5-[(2~{S},3~{R},4~{R},5~{S},6~{R})-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]-1~{H}-1,2,4-triazol-3-yl]phenyl ]-oxidanyl-oxidanylidene-azanium

B1N

B1N
Name:	(1S)-1,5-anhydro-1-(2,5-dihydroxyphenyl)-D-glucitol
Formula:	C14 H17 N3 O6
SMILES:	OC[CH]1O[CH]([CH](O)[CH](O)[CH]1O)c2[nH]nc(n2)c3ccc(O)cc3
InChi:	InChI=1S/C14H17N3O6/c18-5-8-9(20)10(21)11(22)12(23-8)14-15-13(16-17-14)6-1-3-7(19)4-2-6/h1-4,8-12,18-22H,5H2,(H,15,16,17)/t8-,9-,10+,11-,12-/m1/s1
Synonyms:	(2~{R},3~{S},4~{R},5~{R},6~{S})-2-(hydroxymethyl)-6-[3-(4-hydroxyphenyl)-1~{H}-1,2,4-triazol-5-yl]oxane-3,4,5-triol
Definition date:	2017-09-05
Last modified:	2020-07-17
Release date:	2018-02-28
Identifier:	(2~{R},3~{S},4~{R},5~{R},6~{S})-2-(hydroxymethyl)-6-[3-(4-hydroxyphenyl)-1~{H}-1,2,4-triazol-5-yl]oxane-3,4,5-triol

B7G

B7G
Name:	heptyl beta-D-glucopyranoside
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-BETA-D-GLUCOPYRANOSIDE
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	heptyl beta-D-glucopyranoside

B8D

B8D
Name:	4-O-methyl-alpha-D-glucopyranose
Formula:	C7 H14 O6
SMILES:	OC1C(OC)C(OC(O)C1O)CO
InChi:	InChI=1S/C7H14O6/c1-12-6-3(2-8)13-7(11)5(10)4(6)9/h3-11H,2H2,1H3/t3-,4-,5-,6-,7+/m1/s1
Synonyms:	4-O-methyl-alpha-D-glucose
Definition date:	2009-08-18
Last modified:	2020-07-17
Identifier:	4-O-methyl-alpha-D-glucopyranose

BBK

BBK
Name:	2-acetamido-2-deoxy-5-thio-alpha-D-galactopyranose
Formula:	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
Synonyms:	2-(acetylamino)-2-deoxy-5-thio-alpha-D-galactopyranose
Definition date:	2014-04-30
Last modified:	2020-07-17
Release date:	2014-05-28
Identifier:	2-(acetylamino)-2-deoxy-5-thio-alpha-D-galactopyranose

BBV

BBV
Name:	benzyl 2-acetamido-2-deoxy-alpha-D-glucopyranoside
Formula:	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
Synonyms:	benzyl 2-(acetylamino)-2-deoxy-alpha-D-glucopyranoside
Definition date:	2012-04-09
Last modified:	2020-07-17
Identifier:	benzyl 2-(acetylamino)-2-deoxy-alpha-D-glucopyranoside

BDG

BDG
Name:	2,6-diamino-2,6-dideoxy-alpha-D-glucopyranose
Formula:	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
Synonyms:	O-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-D-GLUCOPYRANOSE
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	2,6-diamino-2,6-dideoxy-alpha-D-glucopyranose

CBF

CBF
Name:	(2R,3R,4S,5S,6R)-2,3,4,5-tetrahydroxy-6-(hydroxymethyl)oxane-2-carboxamide
Formula:	C7 H13 N O7
SMILES:	O=C(N)C1(O)OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C7H13NO7/c8-6(13)7(14)5(12)4(11)3(10)2(1-9)15-7/h2-5,9-12,14H,1H2,(H2,8,13)/t2-,3-,4+,5-,7-/m1/s1
Synonyms:	C-(1-HYDROGYL-BETA-D-GLUCOPYRANOSYL) FORMAMIDE
Definition date:	2003-05-01
Last modified:	2020-07-17
Identifier:	(2R,3R,4S,5S,6R)-2,3,4,5-tetrahydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-carboxamide (non-preferred name)

R1P

R1P
Name:	1-O-phosphono-alpha-D-ribofuranose
Formula:	C5 H11 O8 P
SMILES:	O=P(OC1OC(C(O)C1O)CO)(O)O
InChi:	InChI=1S/C5H11O8P/c6-1-2-3(7)4(8)5(12-2)13-14(9,10)11/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5-/m1/s1
Synonyms:	RIBOSE-1-PHOSPHATE
Definition date:	1999-07-08
Last modified:	2020-07-17
Identifier:	1-O-phosphono-alpha-D-ribofuranose

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