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: 35294 件 BIRD

2GL

2GL
表記:	4-O-acetyl-2,6-dideoxy-beta-D-galactopyranose
組成式:	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
別名:	4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-GALACTO-HEXOPYRANOSE
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	4-O-acetyl-2,6-dideoxy-beta-D-lyxo-hexopyranose

2GS

2GS
表記:	2-O-methyl-alpha-D-galactopyranose
組成式:	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
別名:	2-O-methyl-alpha-D-galactose
定義日:	2006-09-26
最終更新日:	2020-07-17
識別子（ID）:	2-O-methyl-alpha-D-galactopyranose

2H5

2H5
表記:	3-deoxy-3-fluoro-beta-D-galactopyranose
組成式:	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
別名:	3-deoxy-3-fluoro-beta-D-galactose
定義日:	2013-10-18
最終更新日:	2020-07-17
公開日:	2014-02-05
識別子（ID）:	3-deoxy-3-fluoro-beta-D-galactopyranose

2M4

2M4
表記:	2-O-alpha-D-mannopyranosyl-alpha-D-mannopyranose
組成式:	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
定義日:	2010-08-16
最終更新日:	2020-07-17
識別子（ID）:	2-O-alpha-D-mannopyranosyl-alpha-D-mannopyranose

2M5

2M5
表記:	methyl 7-deoxy-L-glycero-alpha-D-manno-heptopyranoside
組成式:	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
別名:	methyl 7-deoxy-L-glycero-alpha-D-manno-heptoside
定義日:	2010-08-16
最終更新日:	2020-07-17
識別子（ID）:	methyl 7-deoxy-L-glycero-alpha-D-manno-heptopyranoside

2M8

2M8
表記:	(2R)-3-hydroxy-2-(alpha-D-mannopyranosyloxy)propanoic acid
組成式:	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
別名:	2-O-ALPHA-MANNOSYL-D-GLYCERATE
定義日:	2011-07-14
最終更新日:	2020-07-17
識別子（ID）:	(2R)-3-hydroxy-2-(alpha-D-mannopyranosyloxy)propanoic acid

2OS

2OS
表記:	3-N-OCTANOYLSUCROSE
組成式:	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
別名:	3'-O-N-OCTANOYL-A-D-GLUCOPYRANOSYL-B-D-FRUCTOFURANOSIDE
定義日:	2004-05-02
最終更新日:	2020-07-17
識別子（ID）:	beta-D-fructofuranosyl 3-O-octanoyl-alpha-D-glucopyranoside

EEN

EEN
表記:	2-deoxy-2-[(difluoroacetyl)amino]-alpha-D-galactopyranose
組成式:	C8 H13 F2 N O6
SMILES:	OC[CH]1O[CH](O)[CH](NC(=O)C(F)F)[CH](O)[CH]1O
InChi:	InChI=1S/C8H13F2NO6/c9-6(10)7(15)11-3-5(14)4(13)2(1-12)17-8(3)16/h2-6,8,12-14,16H,1H2,(H,11,15)/t2-,3-,4+,5-,8+/m1/s1
別名:	N-DIFLUOROACETYL-D-GALACTOSAMINE
定義日:	2018-03-16
最終更新日:	2020-07-17
公開日:	2019-02-20
識別子（ID）:	2,2-bis(fluoranyl)-~{N}-[(2~{S},3~{R},4~{R},5~{R},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]ethanamide

EEQ

EEQ
表記:	2-deoxy-2-[(fluoroacetyl)amino]-alpha-D-galactopyranose
組成式:	C8 H14 F N O6
SMILES:	OC[CH]1O[CH](O)[CH](NC(=O)CF)[CH](O)[CH]1O
InChi:	InChI=1S/C8H14FNO6/c9-1-4(12)10-5-7(14)6(13)3(2-11)16-8(5)15/h3,5-8,11,13-15H,1-2H2,(H,10,12)/t3-,5-,6+,7-,8+/m1/s1
別名:	2-fluoranyl-~{N}-[(2~{S},3~{R},4~{R},5~{R},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]ethanamide
定義日:	2018-03-16
最終更新日:	2020-07-17
公開日:	2019-02-20
識別子（ID）:	2-fluoranyl-~{N}-[(2~{S},3~{R},4~{R},5~{R},6~{R})-6-(hydroxymethyl)-2,4,5-tris(oxidanyl)oxan-3-yl]ethanamide

EGA

EGA
表記:	ethyl beta-D-galactopyranoside
組成式:	C8 H16 O6
SMILES:	O(CC)C1OC(C(O)C(O)C1O)CO
InChi:	InChI=1S/C8H16O6/c1-2-13-8-7(12)6(11)5(10)4(3-9)14-8/h4-12H,2-3H2,1H3/t4-,5+,6+,7-,8-/m1/s1
別名:	ethyl beta-D-galactoside
定義日:	2014-05-22
最終更新日:	2020-07-17
公開日:	2014-06-18
識別子（ID）:	ethyl beta-D-galactopyranoside

EMP

EMP
表記:	2,4-dideoxy-4-(ethylamino)-3-O-methyl-alpha-L-threo-pentopyranose
組成式:	C8 H17 N O3
SMILES:	O(C)C1C(NCC)COC(O)C1
InChi:	InChI=1S/C8H17NO3/c1-3-9-6-5-12-8(10)4-7(6)11-2/h6-10H,3-5H2,1-2H3/t6-,7-,8+/m0/s1
別名:	2,4-DIDEOXY-4-(ETHYLAMINO)-3-O-METHYL ALPHA-L-THREO-PENTOPYRANOSIDE
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	2,4-dideoxy-4-(ethylamino)-3-O-methyl-alpha-L-threo-pentopyranose

EMZ

EMZ
表記:	6-O-methyl-beta-D-galactopyranose
組成式:	C7 H14 O6
SMILES:	COC[CH]1O[CH](O)[CH](O)[CH](O)[CH]1O
InChi:	InChI=1S/C7H14O6/c1-12-2-3-4(8)5(9)6(10)7(11)13-3/h3-11H,2H2,1H3/t3-,4+,5+,6-,7-/m1/s1
別名:	6-O-Methyl-D-galactopyranose
定義日:	2018-04-02
最終更新日:	2020-07-17
公開日:	2018-11-21
識別子（ID）:	(2~{R},3~{R},4~{S},5~{R},6~{R})-6-(methoxymethyl)oxane-2,3,4,5-tetrol

EPG

EPG
表記:	(2R)-oxiran-2-ylmethyl alpha-D-glucopyranoside
組成式:	C9 H16 O7
SMILES:	O(CC1OC1)C2OC(C(O)C(O)C2O)CO
InChi:	InChI=1S/C9H16O7/c10-1-5-6(11)7(12)8(13)9(16-5)15-3-4-2-14-4/h4-13H,1-3H2/t4-,5-,6-,7+,8-,9+/m1/s1
別名:	2-HYDROXYMETHYL-6-OXIRANYLMETHOXY-TETRAHYDRO-PYRAN-3,4,5-TRIOL
定義日:	2002-11-28
最終更新日:	2020-07-17
識別子（ID）:	(2R)-oxiran-2-ylmethyl alpha-D-glucopyranoside

EQV

EQV
表記:	Loganic acid
組成式:	C16 H24 O10
SMILES:	CC1C(CC2C(=COC(C12)OC3C(C(C(C(O3)CO)O)O)O)C(=O)O)O
InChi:	InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1
別名:	(1S,4aS,6S,7R,7aS)-1-(beta-D-glucopyranosyloxy)-6-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxyl ic acid
定義日:	2018-01-29
最終更新日:	2020-07-17
公開日:	2018-02-07
識別子（ID）:	(1S,4aS,6S,7R,7aS)-1-(beta-D-glucopyranosyloxy)-6-hydroxy-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxyl ic acid

ERE

ERE
表記:	4-epi-vancosamine
組成式:	C7 H15 N O3
SMILES:	OC1OC(C(O)C(N)(C)C1)C
InChi:	InChI=1S/C7H15NO3/c1-4-6(10)7(2,8)3-5(9)11-4/h4-6,9-10H,3,8H2,1-2H3/t4-,5+,6-,7-/m0/s1
別名:	(1R,3S,4R,5S)-3-amino-2,3,6-trideoxy-3-methyl-alpha-L-arabino-hexopyranose
定義日:	2010-08-12
最終更新日:	2020-07-17
識別子（ID）:	3-amino-2,3,6-trideoxy-3-methyl-alpha-L-arabino-hexopyranose

ERI

ERI
表記:	3-C-methyl-4-O-acetyl-alpha-L-Olivopyranose
組成式:	C9 H16 O5
SMILES:	O=C(OC1C(OC(O)CC1(O)C)C)C
InChi:	InChI=1S/C9H16O5/c1-5-8(14-6(2)10)9(3,12)4-7(11)13-5/h5,7-8,11-12H,4H2,1-3H3/t5-,7+,8-,9-/m0/s1
別名:	4-O-ACETYL-2,6-DIDEOXY-3-C-METHYL-BETA-L-ARABINO-HEXOPYRANOSE
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	4-O-acetyl-2,6-dideoxy-3-C-methyl-alpha-L-arabino-hexopyranose

4GL

4GL
表記:	alpha-D-gulopyranose
組成式:	C6 H12 O6
SMILES:	OC1C(O)C(OC(O)C1O)CO
InChi:	InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4-,5-,6+/m1/s1
別名:	alpha-D-gulose
定義日:	2011-08-18
最終更新日:	2020-07-17
公開日:	2020-07-29
識別子（ID）:	alpha-D-gulopyranose

4GP

4GP
表記:	N-(carboxycarbonyl)-beta-D-glucopyranosylamine
組成式:	C8 H13 N O8
SMILES:	O=C(NC1OC(C(O)C(O)C1O)CO)C(=O)O
InChi:	InChI=1S/C8H13NO8/c10-1-2-3(11)4(12)5(13)7(17-2)9-6(14)8(15)16/h2-5,7,10-13H,1H2,(H,9,14)(H,15,16)/t2-,3-,4+,5-,7-/m1/s1
別名:	N-(BETA-D-GLUCOPYRANOSYL)OXAMIC ACID
定義日:	2006-01-24
最終更新日:	2020-07-17
識別子（ID）:	N-(carboxycarbonyl)-beta-D-glucopyranosylamine

4JA

4JA
表記:	(2S)-3-[(6-deoxy-beta-D-glucopyranosyl)oxy]-2-hydroxypropyl dihydrogen phosphate
組成式:	C9 H19 O10 P
SMILES:	P(OCC(COC1OC(C(O)C(O)C1O)C)O)(=O)(O)O
InChi:	InChI=1S/C9H19O10P/c1-4-6(11)7(12)8(13)9(19-4)17-2-5(10)3-18-20(14,15)16/h4-13H,2-3H2,1H3,(H2,14,15,16)/t4-,5+,6-,7+,8-,9-/m1/s1
別名:	(2S)-3-[(6-deoxy-beta-D-glucosyl)oxy]-2-hydroxypropyl dihydrogen phosphate
定義日:	2015-11-23
最終更新日:	2020-07-17
公開日:	2016-08-31
識別子（ID）:	(2S)-3-[(6-deoxy-beta-D-glucopyranosyl)oxy]-2-hydroxypropyl dihydrogen phosphate

4N2

4N2
表記:	beta-L-idopyranose
組成式:	C6 H12 O6
SMILES:	C1(OC(C(C(C1O)O)O)CO)O
InChi:	InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4-,5+,6-/m0/s1
別名:	beta-L-idose
定義日:	2016-03-21
最終更新日:	2020-07-17
公開日:	2016-06-08
識別子（ID）:	beta-L-idopyranose

4QY

4QY
表記:	2-acetamido-2-deoxy-6-O-phosphono-beta-D-glucopyranose
組成式:	C8 H16 N O9 P
SMILES:	C1(NC(C)=O)C(OC(C(C1O)O)COP(=O)(O)O)O
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
別名:	beta-N-acetylglucosamine-6-phosphate
定義日:	2015-05-13
最終更新日:	2020-07-17
公開日:	2016-06-08
識別子（ID）:	2-(acetylamino)-2-deoxy-6-O-phosphono-beta-D-glucopyranose

4R1

4R1
表記:	2-amino-2-deoxy-6-O-phosphono-beta-D-glucopyranose
組成式:	C6 H14 N O8 P
SMILES:	C1(C(C(O)C(COP(O)(O)=O)OC1O)O)N
InChi:	InChI=1S/C6H14NO8P/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H2,11,12,13)/t2-,3-,4-,5-,6-/m1/s1
別名:	beta-glucosamine-6-phosphate
定義日:	2015-05-13
最終更新日:	2020-07-17
公開日:	2016-06-08
識別子（ID）:	2-amino-2-deoxy-6-O-phosphono-beta-D-glucopyranose

4RS

4RS
表記:	trehalose mono-butyrate
組成式:	C16 H28 O12
SMILES:	C2(OC1C(C(O)C(O)C(COC(=O)CCC)O1)O)C(O)C(C(C(O2)CO)O)O
InChi:	InChI=1S/C16H28O12/c1-2-3-8(18)25-5-7-10(20)12(22)14(24)16(27-7)28-15-13(23)11(21)9(19)6(4-17)26-15/h6-7,9-17,19-24H,2-5H2,1H3/t6-,7-,9-,10-,11+,12+,13-,14-,15-,16-/m1/s1
別名:	6-O-butanoyl-alpha-D-glucopyranosyl alpha-D-glucopyranoside
定義日:	2015-05-15
最終更新日:	2020-07-17
公開日:	2016-05-25
識別子（ID）:	6-O-butanoyl-alpha-D-glucopyranosyl alpha-D-glucopyranoside

4SG

4SG
表記:	4-thio-alpha-D-glucopyranose
組成式:	C6 H12 O5 S
SMILES:	OC1C(S)C(OC(O)C1O)CO
InChi:	InChI=1S/C6H12O5S/c7-1-2-5(12)3(8)4(9)6(10)11-2/h2-10,12H,1H2/t2-,3-,4-,5-,6+/m1/s1
定義日:	2012-08-08
最終更新日:	2020-07-17
公開日:	2020-07-29
識別子（ID）:	4-thio-alpha-D-glucopyranose

ASG

ASG
表記:	2-acetamido-2-deoxy-4-O-sulfo-beta-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-DEOXY-2-ACETAMIDO-BETA-D-GALACTOSE-4-SULFATE
定義日:	1999-07-08
最終更新日:	2020-07-17
識別子（ID）:	2-(acetylamino)-2-deoxy-4-O-sulfo-beta-D-galactopyranose

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