Chemie クエリの検索結果 - 日本蛋白質構造データバンク

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PDB ウェブページステータス検索化合物検索: 899 件 BIRD

05L

05L
表記:	heptyl 1-seleno-beta-D-glucopyranoside
組成式:	C13 H26 O5 Se
SMILES:	[Se](CCCCCCC)C1OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C13H26O5Se/c1-2-3-4-5-6-7-19-13-12(17)11(16)10(15)9(8-14)18-13/h9-17H,2-8H2,1H3/t9-,10-,11+,12-,13+/m1/s1
別名:	heptyl 1-seleno-beta-D-glucoside
定義日:	2011-11-29
最終更新日:	2020-07-17
識別子（ID）:	heptyl 1-seleno-beta-D-glucopyranoside

07E

07E
表記:	(3S)-3-hydroxybutyl beta-D-xylopyranoside
組成式:	C9 H18 O6
SMILES:	O(CCC(O)C)C1OCC(O)C(O)C1O
InChi:	InChI=1S/C9H18O6/c1-5(10)2-3-14-9-8(13)7(12)6(11)4-15-9/h5-13H,2-4H2,1H3/t5-,6+,7-,8+,9+/m0/s1
別名:	(3S)-3-hydroxybutyl beta-D-xyloside
定義日:	2011-09-23
最終更新日:	2020-07-17
公開日:	2017-07-12
識別子（ID）:	(3S)-3-hydroxybutyl beta-D-xylopyranoside

N1L

N1L
表記:	2-amino-2-deoxy-beta-D-glucopyranuronic acid
組成式:	C6 H11 N O6
SMILES:	O=C(O)C1OC(O)C(N)C(O)C1O
InChi:	InChI=1S/C6H11NO6/c7-1-2(8)3(9)4(5(10)11)13-6(1)12/h1-4,6,8-9,12H,7H2,(H,10,11)/t1-,2-,3+,4+,6-/m1/s1
別名:	2-amino-2-deoxy-beta-D-glucuronic acid
定義日:	2008-03-11
最終更新日:	2020-07-17
識別子（ID）:	2-amino-2-deoxy-beta-D-glucopyranuronic acid

NA1

NA1
表記:	2-acetamido-2-deoxy-6-O-methyl-alpha-D-allopyranose
組成式:	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
別名:	METHYL N-ACETYL ALLOSAMINE
定義日:	2003-03-10
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-6-O-methyl-alpha-D-allopyranose

NAA

NAA
表記:	2-acetamido-2-deoxy-beta-D-allopyranose
組成式:	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
別名:	N-acetyl-beta-D-allosamine
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-beta-D-allopyranose

NAG

NAG
表記:	2-acetamido-2-deoxy-beta-D-glucopyranose
組成式:	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
別名:	N-acetyl-beta-D-glucosamine
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-beta-D-glucopyranose

7CV

7CV
表記:	6-deoxy-2,3-di-O-methyl-alpha-L-mannopyranose
組成式:	C8 H16 O5
SMILES:	C1(O)C(OC)C(C(C(O1)C)O)OC
InChi:	InChI=1S/C8H16O5/c1-4-5(9)6(11-2)7(12-3)8(10)13-4/h4-10H,1-3H3/t4-,5-,6+,7+,8+/m0/s1
別名:	6-deoxy-2,3-di-O-methyl-alpha-L-mannose
定義日:	2016-10-05
最終更新日:	2020-07-17
公開日:	2017-10-18
識別子（ID）:	6-deoxy-2,3-di-O-methyl-alpha-L-mannopyranose

7D1

7D1
表記:	1,5-anhydro-2-deoxy-D-arabino-hexitol
組成式:	C6 H12 O4
SMILES:	OC[CH]1OCC[CH](O)[CH]1O
InChi:	InChI=1S/C6H12O4/c7-3-5-6(9)4(8)1-2-10-5/h4-9H,1-3H2/t4-,5-,6+/m1/s1
別名:	(2~{R},3~{S},4~{R})-2-(hydroxymethyl)oxane-3,4-diol
定義日:	2016-10-07
最終更新日:	2020-07-17
公開日:	2017-01-11
識別子（ID）:	(2~{R},3~{S},4~{R})-2-(hydroxymethyl)oxane-3,4-diol

NBG

NBG
表記:	N-acetyl-beta-D-glucopyranosylamine
組成式:	C8 H15 N O6
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)C
InChi:	InChI=1S/C8H15NO6/c1-3(11)9-8-7(14)6(13)5(12)4(2-10)15-8/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5-,6+,7-,8-/m1/s1
別名:	1-N-ACETYL-BETA-D-GLUCOSAMINE
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	N-acetyl-beta-D-glucopyranosylamine

NBX

NBX
表記:	N-{[(4-aminophenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine
組成式:	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
別名:	N-{[(4-aminophenyl)carbonyl]carbamoyl}-beta-D-glucosylamine
定義日:	2008-02-13
最終更新日:	2020-07-17
識別子（ID）:	N-{[(4-aminophenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine

NBY

NBY
表記:	N-{[(4-nitrophenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine
組成式:	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
別名:	N-{[(4-nitrophenyl)carbonyl]carbamoyl}-beta-D-glucosylamine
定義日:	2008-02-13
最終更新日:	2020-07-17
識別子（ID）:	N-{[(4-nitrophenyl)carbonyl]carbamoyl}-beta-D-glucopyranosylamine

NDG

NDG
表記:	2-acetamido-2-deoxy-alpha-D-glucopyranose
組成式:	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
別名:	N-acetyl-alpha-D-glucosamine
定義日:	2002-07-02
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-alpha-D-glucopyranose

7GP

7GP
表記:	N-[ethoxy(oxo)acetyl]-beta-D-glucopyranosylamine
組成式:	C10 H17 N O8
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)C(=O)OCC
InChi:	InChI=1S/C10H17NO8/c1-2-18-10(17)8(16)11-9-7(15)6(14)5(13)4(3-12)19-9/h4-7,9,12-15H,2-3H2,1H3,(H,11,16)/t4-,5-,6+,7-,9-/m1/s1
別名:	ETHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATE
定義日:	2006-01-25
最終更新日:	2020-07-17
識別子（ID）:	N-[ethoxy(oxo)acetyl]-beta-D-glucopyranosylamine

NFG

NFG
表記:	2,4-dinitrophenyl 2-deoxy-2-fluoro-beta-D-glucopyranoside
組成式:	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
別名:	2,4-dinitrophenyl 2-deoxy-2-fluoro-beta-D-glucoside
定義日:	2000-07-07
最終更新日:	2020-07-17
識別子（ID）:	2,4-dinitrophenyl 2-deoxy-2-fluoro-beta-D-glucopyranoside

NG1

NG1
表記:	2-acetamido-2-deoxy-1-O-phosphono-alpha-D-galactopyranose
組成式:	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
別名:	N-ACETYL-ALPHA-D-GALACTOSAMINE 1-PHOSPHATE
定義日:	2005-06-27
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-1-O-phosphono-alpha-D-galactopyranose

NG6

NG6
表記:	2-acetamido-2-deoxy-6-O-sulfo-beta-D-galactopyranose
組成式:	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
別名:	N-ACETYL-D-GALACTOSAMINE 6-SULFATE
定義日:	2000-12-12
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-6-O-sulfo-beta-D-galactopyranose

NGA

NGA
表記:	2-acetamido-2-deoxy-beta-D-galactopyranose
組成式:	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
別名:	N-acetyl-beta-D-galactosamine
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-beta-D-galactopyranose

NGC

NGC
表記:	N-glycolyl-alpha-neuraminic acid
組成式:	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
別名:	N-glycolylneuraminic acid
定義日:	2008-07-25
最終更新日:	2020-07-17
識別子（ID）:	3,5-dideoxy-5-[(hydroxyacetyl)amino]-D-glycero-alpha-D-galacto-non-2-ulopyranosonic acid

NGE

NGE
表記:	N-glycolyl-beta-neuraminic acid
組成式:	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
別名:	N-glycolylneuraminic acid
定義日:	2009-11-05
最終更新日:	2020-07-17
識別子（ID）:	3,5-dideoxy-5-[(hydroxyacetyl)amino]-D-glycero-beta-D-galacto-non-2-ulopyranosonic acid

NGK

NGK
表記:	2-acetamido-2-deoxy-4-O-sulfo-alpha-D-galactopyranose
組成式:	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
別名:	2-(ACETYLAMINO)-2-DEOXY-4-O-SULFO-ALPHA-D-GALACTOPYRANOSE
定義日:	2003-04-15
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-4-O-sulfo-alpha-D-galactopyranose

NGS

NGS
表記:	2-acetamido-2-deoxy-6-O-sulfo-beta-D-glucopyranose
組成式:	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
別名:	2-(acetylamino)-2-deoxy-6-O-sulfo-beta-D-glucopyranose
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-6-O-sulfo-beta-D-glucopyranose

NGY

NGY
表記:	2-acetamido-2-deoxy-6-O-sulfo-alpha-D-glucopyranose
組成式:	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
別名:	2-(acetylamino)-2-deoxy-6-O-sulfo-alpha-D-glucopyranose
定義日:	2008-06-13
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-6-O-sulfo-alpha-D-glucopyranose

NGZ

NGZ
表記:	2-acetamido-2-deoxy-alpha-L-glucopyranose
組成式:	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
別名:	N-acetyl-alpha-L-glucosamine
定義日:	2004-06-10
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-alpha-L-glucopyranose

7JZ

7JZ
表記:	2-deoxy-2,2-difluoro-beta-D-lyxo-hexopyranose
組成式:	C6 H10 F2 O5
SMILES:	FC1(F)C(O)C(O)C(OC1O)CO
InChi:	InChI=1S/C6H10F2O5/c7-6(8)4(11)3(10)2(1-9)13-5(6)12/h2-5,9-12H,1H2/t2-,3+,4+,5-/m1/s1
別名:	2-DEOXY-2,2-DIFLUORO-BETA-D-GALACTOPYRANOSYL-ENZYME INTERMEDIATE
定義日:	2009-05-19
最終更新日:	2020-07-17
識別子（ID）:	2-deoxy-2,2-difluoro-beta-D-lyxo-hexopyranose

7K2

7K2
表記:	[(3S,4R,5R)-4,5-dihydroxypiperidin-3-yl]methyl 1-thio-alpha-D-mannopyranoside
組成式:	C12 H23 N O7 S
SMILES:	OC[CH]1O[CH](SC[CH]2CNC[CH](O)[CH]2O)[CH](O)[CH](O)[CH]1O
InChi:	InChI=1S/C12H23NO7S/c14-3-7-9(17)10(18)11(19)12(20-7)21-4-5-1-13-2-6(15)8(5)16/h5-19H,1-4H2/t5-,6-,7-,8-,9-,10+,11+,12-/m1/s1
別名:	(2~{R},3~{S},4~{S},5~{S},6~{R})-2-[[(3~{S},4~{R},5~{R})-4,5-bis(oxidanyl)piperidin-3-yl]methylsulfanyl]-6-(hydroxymethy l)oxane-3,4,5-triol
定義日:	2016-11-03
最終更新日:	2020-07-17
公開日:	2017-08-09
識別子（ID）:	(2~{R},3~{S},4~{S},5~{S},6~{R})-2-[[(3~{S},4~{R},5~{R})-4,5-bis(oxidanyl)piperidin-3-yl]methylsulfanyl]-6-(hydroxymethy l)oxane-3,4,5-triol

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